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

Systemtic Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-3-[4-(1-azepanyl)phenyl]-2-cyano-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-N-(4-methoxyphenyl)acrylamide Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)N3CCCCCC3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)N3CCCCCC3)/C#N

InChI

InChI=1S/C23H25N3O2/c1-28-22-12-8-20(9-13-22)25-23(27)19(17-24)16-18-6-10-21(11-7-18)26-14-4-2-3-5-15-26/h6-13,16H,2-5,14-15H2,1H3,(H,25,27)/b19-16+