methyl 4-[3-(4-phenylphenyl)carbonylimino-1H-isoindol-2-yl]benzoate

Systemtic Name: methyl 4-[3-(4-phenylphenyl)carbonylimino-1H-isoindol-2-yl]benzoate Openeye Name: methyl 4-[1-(4-phenylbenzoyl)iminoisoindolin-2-yl]benzoate CAS Name: 4-[3-[oxo-(4-phenylphenyl)methyl]imino-1H-isoindol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-phenylbenzoyl)imino-1H-isoindol-2-yl]benzoate Traditional Name: 4-[1-(4-phenylbenzoyl)iminoisoindolin-2-yl]benzoic acid methyl ester Formula: C29H22N2O3 MolecularWeight: 446.49658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2O3/c1-34-29(33)23-15-17-25(18-16-23)31-19-24-9-5-6-10-26(24)27(31)30-28(32)22-13-11-21(12-14-22)20-7-3-2-4-8-20/h2-18H,19H2,1H3