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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(1-methylpyrazol-4-yl)acryloyl]isonipecotamide Formula: C20H22N4O4 MolecularWeight: 382.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N4O4/c1-23-12-14(11-21-23)2-5-19(25)24-8-6-15(7-9-24)20(26)22-16-3-4-17-18(10-16)28-13-27-17/h2-5,10-12,15H,6-9,13H2,1H3,(H,22,26)/b5-2+