2-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid

Systemtic Name: 2-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid Openeye Name: 2-[(4-hydroxy-9,10-dioxo-1-anthryl)amino]benzoic acid CAS Name: 2-[(4-hydroxy-9,10-dioxo-1-anthracenyl)amino]benzoic acid IUPAC Name: 2-[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]benzoic acid Traditional Name: 2-[(4-hydroxy-9,10-diketo-1-anthryl)amino]benzoic acid Formula: C21H13NO5 MolecularWeight: 359.33162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C21H13NO5/c23-16-10-9-15(22-14-8-4-3-7-13(14)21(26)27)17-18(16)20(25)12-6-2-1-5-11(12)19(17)24/h1-10,22-23H,(H,26,27)