PHENAPHTHAZINE FREE ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H10N4O11S2
Molecular Weight	498.401
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=C2C=CC(=CC2=CC(=C1\N=N\C3=CC=C(C=C3[N+]([O-])=O)[N+]([O-])=O)S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=AYCFJUKXFTYTGH-ISLYRVAYSA-N

InChI=1S/C16H10N4O11S2/c21-16-11-3-2-10(32(26,27)28)5-8(11)6-14(33(29,30)31)15(16)18-17-12-4-1-9(19(22)23)7-13(12)20(24)25/h1-7,21H,(H,26,27,28)(H,29,30,31)/b18-17+

HIDE SMILES / InChI

Molecular Formula	C16H10N4O11S2
Molecular Weight	498.401
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 09:06:06 GMT 2025` Edited by `admin` on `Wed Apr 02 09:06:06 GMT 2025`
Record UNII	USH6E4Z2F7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHENAPHTHAZINE FREE ACID

Common Name

English

NCI-9360

Preferred Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 3-((2,4-DINITROPHENYL)AZO)-4-HYDROXY-

Systematic Name

English

1-HYDROXY-2-(2,4-DINITROPHENYLAZO)-3,6-NAPHTHALENEDISULFONIC ACID

Systematic Name

English

3-(2-(2,4-DINITROPHENYL)DIAZENYL)-4-HYDROXY-2,7-NAPHTHALENEDISULFONIC ACID

Systematic Name

English

2-(2,4-DINITROPHENYLAZO)-1-NAPHTHOL-3,6-DISULFONIC ACID

Systematic Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 3-(2-(2,4-DINITROPHENYL)DIAZENYL)-4-HYDROXY-

Systematic Name

English

Code System Code Type Description

CAS

1716-22-9