2-[[3-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid

Systemtic Name: 2-[[3-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzoic acid Openeye Name: 2-[(3-chloro-9,10-dioxo-1-anthryl)amino]benzoic acid CAS Name: 2-[(3-chloro-9,10-dioxo-1-anthracenyl)amino]benzoic acid IUPAC Name: 2-[(3-chloro-9,10-dioxoanthracen-1-yl)amino]benzoic acid Traditional Name: 2-[(3-chloro-9,10-diketo-1-anthryl)amino]benzoic acid Formula: C21H12ClNO4 MolecularWeight: 377.77728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H12ClNO4/c22-11-9-15-18(20(25)13-6-2-1-5-12(13)19(15)24)17(10-11)23-16-8-4-3-7-14(16)21(26)27/h1-10,23H,(H,26,27)