TEBANICLINE TOSYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C9H11ClN2O.C7H8O3S
Molecular Weight	370.851
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.ClC2=CC=C(OC[C@H]3CCN3)C=N2

InChI

InChIKey=JCPWIGCGJUGLJQ-OGFXRTJISA-N

InChI=1S/C9H11ClN2O.C7H8O3S/c10-9-2-1-8(5-12-9)13-6-7-3-4-11-7;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,5,7,11H,3-4,6H2;2-5H,1H3,(H,8,9,10)/t7-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C7H8O3S
Molecular Weight	172.202
Charge	0
Count

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

Molecular Formula	C9H11ClN2O
Molecular Weight	198.649
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:25:54 UTC 2023` Edited by `admin` on `Fri Dec 15 16:25:54 UTC 2023`
Record UNII	CP1A26546Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TEBANICLINE TOSYLATE

Official Name

English

5-(((R)-2-AZETIDNYL)METHOXY)-2-CHLOROPYRIDINE MONO-P-TOLUENESULPHONATE

Systematic Name

English

TEBANICLINE TOSILATE

Common Name

English

PYRIDINE, 5-( (2R)-2-AZETIDINYLMETHOXY)-2-CHLORO-, MONO(4-METHYLBENZENESULPHONATE)

Common Name

English

A-16659447

Code

English

TEBANICLINE TOSYLATE [USAN]

Common Name

English

A-165594

Code

English

5-(((R)-2-AZETIDNYL)METHOXY)-2-CHLOROPYRIDINE MONO-P-TOLUENESULFONATE

Systematic Name

English

TEBANICLINE TOSYLATE [MI]

Common Name

English

PYRIDINE, 5-( (2R)-2-AZETIDINYLMETHOXY)-2-CHLORO-, MONO(4-METHYLBENZENESULFONATE)

Systematic Name

English

A-166594.47

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C73579