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

Systemtic Name: methyl 3-[[1,3-bis(oxidanylidene)-2-(1-phenylethyl)isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[1,3-dioxo-2-(1-phenylethyl)isoindoline-5-carbonyl]amino]benzoate CAS Name: 3-[[[1,3-dioxo-2-(1-phenylethyl)-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1,3-dioxo-2-(1-phenylethyl)isoindole-5-carbonyl]amino]benzoate Traditional Name: 3-[[1,3-diketo-2-(1-phenylethyl)isoindoline-5-carbonyl]amino]benzoic acid methyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C25H20N2O5/c1-15(16-7-4-3-5-8-16)27-23(29)20-12-11-17(14-21(20)24(27)30)22(28)26-19-10-6-9-18(13-19)25(31)32-2/h3-15H,1-2H3,(H,26,28)