3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid

Systemtic Name: 3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid Openeye Name: 3-[(9,10-dioxo-1-anthryl)amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid CAS Name: 3-[(9,10-dioxo-1-anthracenyl)amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid IUPAC Name: 3-[(9,10-dioxoanthracen-1-yl)amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid Traditional Name: 3-[(9,10-diketo-1-anthryl)amino]cyclohexa-1,5-diene-1,3-dicarboxylic acid Formula: C22H15NO6 MolecularWeight: 389.3576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CC1(C(=O)O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)O

Isomeric SMILES

C1C=CC(=CC1(C(=O)O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)O

InChI

InChI=1S/C22H15NO6/c24-18-13-6-1-2-7-14(13)19(25)17-15(18)8-3-9-16(17)23-22(21(28)29)10-4-5-12(11-22)20(26)27/h1-9,11,23H,10H2,(H,26,27)(H,28,29)