2-[[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoate

Systemtic Name: 2-[[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoate Openeye Name: 2-[(4-amino-9,10-dioxo-1-anthryl)amino]benzoate CAS Name: 2-[(4-amino-9,10-dioxo-1-anthracenyl)amino]benzoate IUPAC Name: 2-[(4-amino-9,10-dioxoanthracen-1-yl)amino]benzoate Traditional Name: 2-[(4-amino-9,10-diketo-1-anthryl)amino]benzoate Formula: C21H13N2O4- MolecularWeight: 357.33892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC=CC=C4C(=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC=CC=C4C(=O)[O-])N

InChI

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