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Details

Stereochemistry ACHIRAL
Molecular Formula C21H13NO4
Molecular Weight 343.3322
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYL 1-AMINOANTHRAQUINONE-2-CARBOXYLATE

SMILES

NC1=C(C=CC2=C1C(=O)C3=CC=CC=C3C2=O)C(=O)OC4=CC=CC=C4

InChI

InChIKey=TVOHODCSYVIPTF-UHFFFAOYSA-N
InChI=1S/C21H13NO4/c22-18-16(21(25)26-12-6-2-1-3-7-12)11-10-15-17(18)20(24)14-9-5-4-8-13(14)19(15)23/h1-11H,22H2

HIDE SMILES / InChI

Molecular Formula C21H13NO4
Molecular Weight 343.3322
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 Mon Mar 31 18:22:35 GMT 2025
Edited
by admin
on Mon Mar 31 18:22:35 GMT 2025
Record UNII
SY370FM59F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-AMINOANTHRAQUINONE-2-CARBOXYLIC ACID PHENYL ESTER [MI]
Preferred Name English
PHENYL 1-AMINOANTHRAQUINONE-2-CARBOXYLATE
Systematic Name English
1-AMINOANTHRAQUINONE-2-CARBOXYLIC ACID, PHENYL ESTER
Common Name English
2-ANTHROIC ACID, 1-AMINO-9,10-DIHYDRO-9,10-DIOXO-, PHENYL ESTER
Common Name English
2-ANTHRACENECARBOXYLIC ACID, 1-AMINO-9,10-DIHYDRO-9,10-DIOXO-, PHENYL ESTER
Common Name English
Code System Code Type Description
PUBCHEM
2835177
Created by admin on Mon Mar 31 18:22:35 GMT 2025 , Edited by admin on Mon Mar 31 18:22:35 GMT 2025
PRIMARY
CAS
5959-02-4
Created by admin on Mon Mar 31 18:22:35 GMT 2025 , Edited by admin on Mon Mar 31 18:22:35 GMT 2025
PRIMARY
MERCK INDEX
m1682
Created by admin on Mon Mar 31 18:22:35 GMT 2025 , Edited by admin on Mon Mar 31 18:22:35 GMT 2025
PRIMARY Merck Index
FDA UNII
SY370FM59F
Created by admin on Mon Mar 31 18:22:35 GMT 2025 , Edited by admin on Mon Mar 31 18:22:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID30974982
Created by admin on Mon Mar 31 18:22:35 GMT 2025 , Edited by admin on Mon Mar 31 18:22:35 GMT 2025
PRIMARY