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

Systemtic Name: 1-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(E)-3-[4-(1-azepanyl)phenyl]-1-oxoprop-2-enyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[(E)-3-[4-(azepan-1-yl)phenyl]acryloyl]-N-phenyl-isonipecotamide Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=CC(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=C/C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2/c31-26(15-12-22-10-13-25(14-11-22)29-18-6-1-2-7-19-29)30-20-16-23(17-21-30)27(32)28-24-8-4-3-5-9-24/h3-5,8-15,23H,1-2,6-7,16-21H2,(H,28,32)/b15-12+