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

Systemtic Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-benzyl-2-cyano-prop-2-enamide CAS Name: (E)-3-[4-(1-azepanyl)phenyl]-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-benzyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-[4-(azepan-1-yl)phenyl]-N-benzyl-2-cyano-acrylamide Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O/c24-17-21(23(27)25-18-20-8-4-3-5-9-20)16-19-10-12-22(13-11-19)26-14-6-1-2-7-15-26/h3-5,8-13,16H,1-2,6-7,14-15,18H2,(H,25,27)/b21-16+