(E)-3-[4-(azepan-1-yl)phenyl]-N-butyl-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-butyl-2-cyano-prop-2-enamide Openeye Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-butyl-2-cyano-prop-2-enamide CAS Name: (E)-3-[4-(1-azepanyl)phenyl]-N-butyl-2-cyano-2-propenamide IUPAC Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-butyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-butyl-2-cyano-acrylamide Formula: C20H27N3O MolecularWeight: 325.44788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC=C(C=C1)N2CCCCCC2)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CC=C(C=C1)N2CCCCCC2)/C#N

InChI

InChI=1S/C20H27N3O/c1-2-3-12-22-20(24)18(16-21)15-17-8-10-19(11-9-17)23-13-6-4-5-7-14-23/h8-11,15H,2-7,12-14H2,1H3,(H,22,24)/b18-15+