[1-[(3-aminophenyl)amino]-9,10-bis(oxidanylidene)anthracen-2-yl] hydrogen sulfate

Systemtic Name: [1-[(3-aminophenyl)amino]-9,10-bis(oxidanylidene)anthracen-2-yl] hydrogen sulfate Openeye Name: [1-(3-aminoanilino)-9,10-dioxo-2-anthryl] hydrogen sulfate CAS Name: sulfuric acid [1-(3-aminoanilino)-9,10-dioxo-2-anthracenyl] ester IUPAC Name: [1-(3-aminoanilino)-9,10-dioxoanthracen-2-yl] hydrogen sulfate Traditional Name: sulfuric acid [1-(3-aminoanilino)-9,10-diketo-2-anthryl] ester Formula: C20H14N2O6S MolecularWeight: 410.39996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)OS(=O)(=O)O)NC4=CC=CC(=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)OS(=O)(=O)O)NC4=CC=CC(=C4)N

InChI

InChI=1S/C20H14N2O6S/c21-11-4-3-5-12(10-11)22-18-16(28-29(25,26)27)9-8-15-17(18)20(24)14-7-2-1-6-13(14)19(15)23/h1-10,22H,21H2,(H,25,26,27)