(E)-2-cyano-N-(furan-2-ylmethyl)-3-(2-methyl-4-piperidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(furan-2-ylmethyl)-3-(2-methyl-4-piperidin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2-furylmethyl)-3-[2-methyl-4-(1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2-furanylmethyl)-3-[2-methyl-4-(1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(furan-2-ylmethyl)-3-(2-methyl-4-piperidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2-furfuryl)-3-(2-methyl-4-piperidino-phenyl)acrylamide Formula: C21H23N3O2 MolecularWeight: 349.42622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCCC2)C=C(C#N)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCCC2)/C=C(\C#N)/C(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H23N3O2/c1-16-12-19(24-9-3-2-4-10-24)8-7-17(16)13-18(14-22)21(25)23-15-20-6-5-11-26-20/h5-8,11-13H,2-4,9-10,15H2,1H3,(H,23,25)/b18-13+