N-[(2S)-butan-2-yl]-N-(phenylmethyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-N-(phenylmethyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-benzyl-N-[(1S)-1-methylpropyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-[(2S)-butan-2-yl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-N-[(1S)-1-methylpropyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CC=C1)C(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)N(CC1=CC=CC=C1)C(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O2/c1-3-21(2)28(20-23-12-8-5-9-13-23)26(30)24-16-18-27(19-17-24)25(29)15-14-22-10-6-4-7-11-22/h4-15,21,24H,3,16-20H2,1-2H3/b15-14+/t21-/m0/s1