ethyl 3-[[(2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: ethyl 3-[[(2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoyl]amino]benzoate Openeye Name: ethyl 3-[[(2S)-2-(1-oxoisoindolin-2-yl)-3-phenyl-propanoyl]amino]benzoate CAS Name: 3-[[(2S)-1-oxo-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(2S)-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoyl]amino]benzoate Traditional Name: 3-[[(2S)-2-(1-ketoisoindolin-2-yl)-3-phenyl-propanoyl]amino]benzoic acid ethyl ester Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H24N2O4/c1-2-32-26(31)19-12-8-13-21(16-19)27-24(29)23(15-18-9-4-3-5-10-18)28-17-20-11-6-7-14-22(20)25(28)30/h3-14,16,23H,2,15,17H2,1H3,(H,27,29)/t23-/m0/s1