1-Amino-9,10-dihydro-4-((4-((2-hydroxyethyl)sulfonyl)phenyl)amino)-9,10-dioxoanthracene-2-sulfonic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H18N2O8S2
Molecular Weight	502.517
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-Amino-9,10-dihydro-4-((4-((2-hydroxyethyl)sulfonyl)phenyl)amino)-9,10-dioxoanthracene-2-sulfonic acid

Structure Search

SMILES

NC1=C(C=C(NC2=CC=C(C=C2)S(=O)(=O)CCO)C3=C1C(=O)C4=CC=CC=C4C3=O)S(O)(=O)=O

InChI

InChIKey=FDTPKQJEJXREHN-UHFFFAOYSA-N

InChI=1S/C22H18N2O8S2/c23-20-17(34(30,31)32)11-16(24-12-5-7-13(8-6-12)33(28,29)10-9-25)18-19(20)22(27)15-4-2-1-3-14(15)21(18)26/h1-8,11,24-25H,9-10,23H2,(H,30,31,32)

HIDE SMILES / InChI

Molecular Formula	C22H18N2O8S2
Molecular Weight	502.517
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 20:06:43 GMT 2023` Edited by `admin` on `Sat Dec 16 20:06:43 GMT 2023`
Record UNII	VVX7HA5SBT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Amino-9,10-dihydro-4-((4-((2-hydroxyethyl)sulfonyl)phenyl)amino)-9,10-dioxoanthracene-2-sulfonic acid

Systematic Name

English

2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[(2-hydroxyethyl)sulfonyl]phenyl]amino]-9,10-dioxo-

Systematic Name

English

1-Amino-9,10-dihydro-4-[[4-[(2-hydroxyethyl)sulfonyl]phenyl]amino]-9,10-dioxo-2-anthracenesulfonic acid

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

270-000-5