methyl 6-chloranyl-3-oxidanylidene-2-(phenylmethyl)-1H-benzo[f]isoindole-4-carboxylate

Systemtic Name: methyl 6-chloranyl-3-oxidanylidene-2-(phenylmethyl)-1H-benzo[f]isoindole-4-carboxylate Openeye Name: methyl 2-benzyl-6-chloro-3-oxo-1H-benzo[f]isoindole-4-carboxylate CAS Name: 6-chloro-3-oxo-2-(phenylmethyl)-1H-benzo[f]isoindole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-6-chloro-3-oxo-1H-benzo[f]isoindole-4-carboxylate Traditional Name: 2-benzyl-6-chloro-3-keto-1H-benz[f]isoindole-4-carboxylic acid methyl ester Formula: C21H16ClNO3 MolecularWeight: 365.80964

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=C(C=CC2=CC3=C1C(=O)N(C3)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC(=O)C1=C2C=C(C=CC2=CC3=C1C(=O)N(C3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H16ClNO3/c1-26-21(25)19-17-10-16(22)8-7-14(17)9-15-12-23(20(24)18(15)19)11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3