DEQUALINIUM UNDECENATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H40N4.2C11H19O2
Molecular Weight	823.2001
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[O-]C(=O)CCCCCCCCC=C.[O-]C(=O)CCCCCCCCC=C.CC1=[N+](CCCCCCCCCC[N+]2=C(C)C=C(N)C3=C2C=CC=C3)C4=C(C=CC=C4)C(N)=C1

InChI

InChIKey=ADVZBZHXUINOFY-UHFFFAOYSA-N

InChI=1S/C30H38N4.2C11H20O2/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34;2*1-2-3-4-5-6-7-8-9-10-11(12)13/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3;2*2H,1,3-10H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C11H20O2
Molecular Weight	184.2753
Charge	0
Count

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

Molecular Formula	C30H38N4
Molecular Weight	454.6495
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:10:30 UTC 2023` Edited by `admin` on `Sat Dec 16 08:10:30 UTC 2023`
Record UNII	89J4L3V7VP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DEQUALINIUM UNDECENATE

Common Name

English

Dequalinium undecenate [WHO-DD]

Common Name

English

QUINALDINIUM, 1,1'-DECAMETHYLENEBIS(4-AMINO-, DI-10-UNDECENOATE

Systematic Name

English

DEQUALINIUM DI-10-UNDECENATE

Common Name

English

10-UNDECENOIC ACID, ION(1-), 1,1'-DECAMETHYLENEBIS(4-AMINOQUINALDINIUM) (2:1)

Systematic Name

English

10-UNDECENOIC ACID, ION(1-), 1,1'-(1,10-DECANEDIYL)BIS(4-AMINO-2-METHYLQUINOLINIUM) (2:1)

Systematic Name

English

Code System Code Type Description

EVMPD

SUB01593MIG