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

Systemtic Name: ethyl 3-[[1,3-bis(oxidanylidene)-2-(1-phenylethyl)isoindol-5-yl]carbonylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C(C)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O5/c1-3-33-26(32)19-10-7-11-20(14-19)27-23(29)18-12-13-21-22(15-18)25(31)28(24(21)30)16(2)17-8-5-4-6-9-17/h4-16H,3H2,1-2H3,(H,27,29)