N-(1,3-benzodioxol-5-yl)-1-[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[1-[(E)-3-phenylacryloyl]isonipecotoyl]isonipecotamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O5/c32-26(9-6-20-4-2-1-3-5-20)30-14-12-22(13-15-30)28(34)31-16-10-21(11-17-31)27(33)29-23-7-8-24-25(18-23)36-19-35-24/h1-9,18,21-22H,10-17,19H2,(H,29,33)/b9-6+