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

Systemtic Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]-N-phenyl-isonipecotamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O4/c25-21(9-7-16-6-8-19-20(14-16)28-15-27-19)24-12-10-17(11-13-24)22(26)23-18-4-2-1-3-5-18/h1-9,14,17H,10-13,15H2,(H,23,26)/b9-7+