CHOCOLATE BROWN HT FREE ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H20N4O9S2
Molecular Weight	608.599
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of CHOCOLATE BROWN HT FREE ACID

Structure Search

SMILES

OCC1=C(O)C(\N=N\C2=C3C=CC=CC3=C(C=C2)S(O)(=O)=O)=C(O)C(=C1)\N=N\C4=CC=C(C5=C4C=CC=C5)S(O)(=O)=O

InChI

InChIKey=ZMJZWRQKSFYRJU-FUEWEDNTSA-N

InChI=1S/C27H20N4O9S2/c32-14-15-13-22(30-28-20-9-11-23(41(35,36)37)18-7-3-1-5-16(18)20)27(34)25(26(15)33)31-29-21-10-12-24(42(38,39)40)19-8-4-2-6-17(19)21/h1-13,32-34H,14H2,(H,35,36,37)(H,38,39,40)/b30-28+,31-29+

HIDE SMILES / InChI

Molecular Formula	C27H20N4O9S2
Molecular Weight	608.599
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	2
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:57:34 GMT 2023` Edited by `admin` on `Sat Dec 16 01:57:34 GMT 2023`
Record UNII	RH77QMZ6Y1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHOCOLATE BROWN HT FREE ACID

Common Name

English

1-NAPHTHALENESULFONIC ACID, 4,4'-((2,4-DIHYDROXY-5-(HYDROXYMETHYL)-1,3-PHENYLENE)BIS(AZO))BIS-

Common Name

English

Code System Code Type Description

FDA UNII

RH77QMZ6Y1