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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-fluorophenyl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-fluorophenyl)prop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-fluorophenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-fluorophenyl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(E)-3-(3-fluorophenyl)acryloyl]isonipecotamide Formula: C22H21FN2O4 MolecularWeight: 396.411543

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O4/c23-17-3-1-2-15(12-17)4-7-21(26)25-10-8-16(9-11-25)22(27)24-18-5-6-19-20(13-18)29-14-28-19/h1-7,12-13,16H,8-11,14H2,(H,24,27)/b7-4+