2-[[5-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid

Systemtic Name: 2-[[5-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid Openeye Name: 2-[(5-amino-9,10-dioxo-1-anthryl)amino]benzoic acid CAS Name: 2-[(5-amino-9,10-dioxo-1-anthracenyl)amino]benzoic acid IUPAC Name: 2-[(5-amino-9,10-dioxoanthracen-1-yl)amino]benzoic acid Traditional Name: 2-[(5-amino-9,10-diketo-1-anthryl)amino]benzoic acid Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)N

InChI

InChI=1S/C21H14N2O4/c22-14-8-3-6-12-17(14)19(24)13-7-4-10-16(18(13)20(12)25)23-15-9-2-1-5-11(15)21(26)27/h1-10,23H,22H2,(H,26,27)