[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanoic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoate Traditional Name: 3-phenyl-2-phthalimido-propionic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C27H20N2O5 MolecularWeight: 452.4581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CNC3=CC=CC=C32)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CNC3=CC=CC=C32)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H20N2O5/c30-24(21-15-28-22-13-7-6-10-18(21)22)16-34-27(33)23(14-17-8-2-1-3-9-17)29-25(31)19-11-4-5-12-20(19)26(29)32/h1-13,15,23,28H,14,16H2