(4-cyanophenyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate

Systemtic Name: (4-cyanophenyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate Openeye Name: (4-cyanophenyl) (2S)-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) (2S)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-phthalimido-propionic acid (4-cyanophenyl) ester Formula: C24H16N2O4 MolecularWeight: 396.39484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OC2=CC=C(C=C2)C#N)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OC2=CC=C(C=C2)C#N)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H16N2O4/c25-15-17-10-12-18(13-11-17)30-24(29)21(14-16-6-2-1-3-7-16)26-22(27)19-8-4-5-9-20(19)23(26)28/h1-13,21H,14H2/t21-/m0/s1