2-[2-[(3-methylphenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1H-indol-3-yl]ethyl benzoate

Systemtic Name: 2-[2-[(3-methylphenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1H-indol-3-yl]ethyl benzoate Openeye Name: 2-[2-[(2-hydroxy-4-oxo-chromen-3-yl)-(m-tolyl)methyl]-1H-indol-3-yl]ethyl benzoate CAS Name: benzoic acid 2-[2-[(2-hydroxy-4-oxo-1-benzopyran-3-yl)-(3-methylphenyl)methyl]-1H-indol-3-yl]ethyl ester IUPAC Name: 2-[2-[(2-hydroxy-4-oxochromen-3-yl)-(3-methylphenyl)methyl]-1H-indol-3-yl]ethyl benzoate Traditional Name: benzoic acid 2-[2-[(2-hydroxy-4-keto-chromen-3-yl)-(m-tolyl)methyl]-1H-indol-3-yl]ethyl ester Formula: C34H27NO5 MolecularWeight: 529.58188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC=CC=C6

InChI

InChI=1S/C34H27NO5/c1-21-10-9-13-23(20-21)29(30-32(36)26-15-6-8-17-28(26)40-34(30)38)31-25(24-14-5-7-16-27(24)35-31)18-19-39-33(37)22-11-3-2-4-12-22/h2-17,20,29,35,38H,18-19H2,1H3