methyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(E)-2-cyano-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(E)-2-cyano-3-p-cumenyl-acryloyl]oxyacetyl]isonipecotic acid methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C22H26N2O5/c1-15(2)17-6-4-16(5-7-17)12-19(13-23)22(27)29-14-20(25)24-10-8-18(9-11-24)21(26)28-3/h4-7,12,15,18H,8-11,14H2,1-3H3/b19-12+