N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(phenylmethyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(phenylmethyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-benzyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(1-oxo-3-phenylpropyl)-4-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-benzyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide Traditional Name: 4-benzyl-N-homopiperonyl-1-hydrocinnamoyl-isonipecotamide Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4)C(=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4)C(=O)CCC5=CC=CC=C5

InChI

InChI=1S/C31H34N2O4/c34-29(14-12-24-7-3-1-4-8-24)33-19-16-31(17-20-33,22-26-9-5-2-6-10-26)30(35)32-18-15-25-11-13-27-28(21-25)37-23-36-27/h1-11,13,21H,12,14-20,22-23H2,(H,32,35)