phenacyl (3S)-1-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: phenacyl (3S)-1-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: phenacyl (3S)-1-[4-(1,3-dioxoisoindolin-2-yl)phenyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[4-(1,3-dioxo-2-isoindolyl)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid phenacyl ester IUPAC Name: phenacyl (3S)-1-[4-(1,3-dioxoisoindol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(4-phthalimidophenyl)pyrrolidine-3-carboxylic acid phenacyl ester Formula: C27H20N2O6 MolecularWeight: 468.4575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O6/c30-23(17-6-2-1-3-7-17)16-35-27(34)18-14-24(31)28(15-18)19-10-12-20(13-11-19)29-25(32)21-8-4-5-9-22(21)26(29)33/h1-13,18H,14-16H2/t18-/m0/s1