prop-2-enyl (E)-2-cyano-3-(4-piperidin-1-ylphenyl)prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-cyano-3-(4-piperidin-1-ylphenyl)prop-2-enoate Openeye Name: allyl (E)-2-cyano-3-[4-(1-piperidyl)phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(1-piperidinyl)phenyl]-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-cyano-3-(4-piperidin-1-ylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-piperidinophenyl)acrylic acid allyl ester Formula: C18H20N2O2 MolecularWeight: 296.3636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC=C(C=C1)N2CCCCC2)C#N

Isomeric SMILES

C=CCOC(=O)/C(=C/C1=CC=C(C=C1)N2CCCCC2)/C#N

InChI

InChI=1S/C18H20N2O2/c1-2-12-22-18(21)16(14-19)13-15-6-8-17(9-7-15)20-10-4-3-5-11-20/h2,6-9,13H,1,3-5,10-12H2/b16-13+