2-BUTYL-3-(P-TOLYL)QUINUCLIDINE HYDROCHLORIDE, (-)-

Details

Stereochemistry	UNKNOWN
Molecular Formula	C18H27N.ClH
Molecular Weight	293.875
Optical Activity	( - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-BUTYL-3-(P-TOLYL)QUINUCLIDINE HYDROCHLORIDE, (-)-

Structure Search

SMILES

Cl.CCCC[C@@H]1[C@@H](C2CCN1CC2)C3=CC=C(C)C=C3

InChI

InChIKey=ADLXQEBEJYLYJJ-JAXOOIEVSA-N

InChI=1S/C18H27N.ClH/c1-3-4-5-17-18(15-8-6-14(2)7-9-15)16-10-12-19(17)13-11-16;/h6-9,16-18H,3-5,10-13H2,1-2H3;1H/t17-,18-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C18H27N
Molecular Weight	257.4137
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:39:49 GMT 2025` Edited by `admin` on `Wed Apr 02 11:39:49 GMT 2025`
Record UNII	W853TL89RY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-BUTYL-3-(P-TOLYL)QUINUCLIDINE HYDROCHLORIDE, (-)-

Common Name

English

1-AZABICYCLO(2.2.2)OCTANE, 2-BUTYL-3-(4-METHYLPHENYL)-, HYDROCHLORIDE (1:1), (2R,3S)-REL-(-)-

Preferred Name

English

1-AZABICYCLO(2.2.2)OCTANE, 2-BUTYL-3-(4-METHYLPHENYL)-, HYDROCHLORIDE, (2R,3S)-REL-(-)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

155884425

Created by admin on Wed Apr 02 11:39:49 GMT 2025 , Edited by admin on Wed Apr 02 11:39:49 GMT 2025

PRIMARY

FDA UNII

W853TL89RY

Created by admin on Wed Apr 02 11:39:49 GMT 2025 , Edited by admin on Wed Apr 02 11:39:49 GMT 2025

PRIMARY

CAS

561298-91-7

Created by admin on Wed Apr 02 11:39:49 GMT 2025 , Edited by admin on Wed Apr 02 11:39:49 GMT 2025

PRIMARY

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