1-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]-N-phenyl-nipecotamide Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCO3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H21ClN2O4/c23-18-11-15(12-19-21(18)29-14-28-19)8-9-20(26)25-10-4-5-16(13-25)22(27)24-17-6-2-1-3-7-17/h1-3,6-9,11-12,16H,4-5,10,13-14H2,(H,24,27)/b9-8+