4-[[[1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindol-5-yl]carbonylamino]methyl]benzoate

Systemtic Name: 4-[[[1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindol-5-yl]carbonylamino]methyl]benzoate Openeye Name: 4-[[[1,3-dioxo-2-(2-phenylphenyl)isoindoline-5-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[1,3-dioxo-2-(2-phenylphenyl)-5-isoindolyl]-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[[1,3-dioxo-2-(2-phenylphenyl)isoindole-5-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[1,3-diketo-2-(2-phenylphenyl)isoindoline-5-carbonyl]amino]methyl]benzoate Formula: C29H19N2O5- MolecularWeight: 475.47156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NCC5=CC=C(C=C5)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NCC5=CC=C(C=C5)C(=O)[O-]

InChI

InChI=1S/C29H20N2O5/c32-26(30-17-18-10-12-20(13-11-18)29(35)36)21-14-15-23-24(16-21)28(34)31(27(23)33)25-9-5-4-8-22(25)19-6-2-1-3-7-19/h1-16H,17H2,(H,30,32)(H,35,36)/p-1