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

Systemtic Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[4-(1-azepanyl)phenyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-isopropyl-acrylamide Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O/c1-15(2)21-19(23)17(14-20)13-16-7-9-18(10-8-16)22-11-5-3-4-6-12-22/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,21,23)/b17-13+