ALTERNATIVE DEFINITION for [MORDANT RED 19]

Details

Stereochemistry	RACEMIC
Molecular Formula	C16H12ClN4O5S.Na
Molecular Weight	430.798
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [MORDANT RED 19]

Structure Search

SMILES

[Na+].CC1=NN(C(=O)C1\N=N\C2=C(O)C(=CC(Cl)=C2)S([O-])(=O)=O)C3=CC=CC=C3

InChI

InChIKey=IJXYCMDHQBXUJW-LTRPLHCISA-M

InChI=1S/C16H13ClN4O5S.Na/c1-9-14(16(23)21(20-9)11-5-3-2-4-6-11)19-18-12-7-10(17)8-13(15(12)22)27(24,25)26;/h2-8,14,22H,1H3,(H,24,25,26);/q;+1/p-1/b19-18+;

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

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

Molecular Formula	C16H12ClN4O5S
Molecular Weight	407.808
Charge	-1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:33:07 GMT 2025` Edited by `admin` on `Wed Apr 02 10:33:07 GMT 2025`
Record UNII	AJ4ZXK9QEQ
Record Status	`alternative`
Record Version

Download


					AJ4ZXK9QEQ

MORDANT RED 19

Related Record Type Details


					AJ4ZXK9QEQ

MORDANT RED 19

Primary Definition