N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-benzyloxyphenyl)prop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-1-oxo-3-(3-phenylmethoxyphenyl)prop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-benzoxyphenyl)acryloyl]isonipecotamide Formula: C29H28N2O5 MolecularWeight: 484.54302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C=CC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)/C=C/C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H28N2O5/c32-28(12-9-21-7-4-8-25(17-21)34-19-22-5-2-1-3-6-22)31-15-13-23(14-16-31)29(33)30-24-10-11-26-27(18-24)36-20-35-26/h1-12,17-18,23H,13-16,19-20H2,(H,30,33)/b12-9+