(2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-N-[1-(phenylmethyl)piperidin-4-yl]propanamide

Systemtic Name: (2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-N-[1-(phenylmethyl)piperidin-4-yl]propanamide Openeye Name: (2S)-N-(1-benzyl-4-piperidyl)-2-(1-oxoisoindolin-2-yl)-3-phenyl-propanamide CAS Name: (2S)-2-(3-oxo-1H-isoindol-2-yl)-3-phenyl-N-[1-(phenylmethyl)-4-piperidinyl]propanamide IUPAC Name: (2S)-N-(1-benzylpiperidin-4-yl)-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanamide Traditional Name: (2S)-N-(1-benzyl-4-piperidyl)-2-(1-ketoisoindolin-2-yl)-3-phenyl-propionamide Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C(CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)[C@H](CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O2/c33-28(30-25-15-17-31(18-16-25)20-23-11-5-2-6-12-23)27(19-22-9-3-1-4-10-22)32-21-24-13-7-8-14-26(24)29(32)34/h1-14,25,27H,15-21H2,(H,30,33)/t27-/m0/s1