2-[4-(phenylmethyl)piperidin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]-N-propan-2-yl-benzamide

Systemtic Name: 2-[4-(phenylmethyl)piperidin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]-N-propan-2-yl-benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-isopropyl-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide CAS Name: 5-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-2-[4-(phenylmethyl)-1-piperidinyl]-N-propan-2-ylbenzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-N-propan-2-ylbenzamide Traditional Name: 2-(4-benzylpiperidino)-N-isopropyl-5-[[(E)-3-phenylacryloyl]amino]benzamide Formula: C31H35N3O2 MolecularWeight: 481.6285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=CC=C2)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=CC=C2)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C31H35N3O2/c1-23(2)32-31(36)28-22-27(33-30(35)16-13-24-9-5-3-6-10-24)14-15-29(28)34-19-17-26(18-20-34)21-25-11-7-4-8-12-25/h3-16,22-23,26H,17-21H2,1-2H3,(H,32,36)(H,33,35)/b16-13+