(E)-3-(4-butoxyphenyl)-2-cyano-N-(4-piperidin-1-ylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(4-piperidin-1-ylphenyl)prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(4-piperidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(4-piperidinophenyl)acrylamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C25H29N3O2/c1-2-3-17-30-24-13-7-20(8-14-24)18-21(19-26)25(29)27-22-9-11-23(12-10-22)28-15-5-4-6-16-28/h7-14,18H,2-6,15-17H2,1H3,(H,27,29)/b21-18+