3-[4-[[4,7-bis(chloranyl)-2,3-bis(oxidanylidene)indol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 3-[4-[[4,7-bis(chloranyl)-2,3-bis(oxidanylidene)indol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 3-[4-[(4,7-dichloro-2,3-dioxo-indolin-1-yl)methyl]phenyl]benzoic acid CAS Name: 3-[4-[(4,7-dichloro-2,3-dioxo-1-indolyl)methyl]phenyl]benzoic acid IUPAC Name: 3-[4-[(4,7-dichloro-2,3-dioxoindol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 3-[4-[(4,7-dichloro-2,3-diketo-indolin-1-yl)methyl]phenyl]benzoic acid Formula: C22H13Cl2NO4 MolecularWeight: 426.24892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=CC=C(C=C2)CN3C4=C(C=CC(=C4C(=O)C3=O)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=CC=C(C=C2)CN3C4=C(C=CC(=C4C(=O)C3=O)Cl)Cl

InChI

InChI=1S/C22H13Cl2NO4/c23-16-8-9-17(24)19-18(16)20(26)21(27)25(19)11-12-4-6-13(7-5-12)14-2-1-3-15(10-14)22(28)29/h1-10H,11H2,(H,28,29)