[(E)-3-phenylprop-2-enyl] 1-(4-ethoxycarbonylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 1-(4-ethoxycarbonylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(E)-cinnamyl] 1-(4-ethoxycarbonylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxycarbonylphenyl)sulfonyl-4-piperidinecarboxylic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 1-(4-ethoxycarbonylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-carbethoxyphenyl)sulfonylisonipecotic acid [(E)-cinnamyl] ester Formula: C24H27NO6S MolecularWeight: 457.53928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H27NO6S/c1-2-30-23(26)20-10-12-22(13-11-20)32(28,29)25-16-14-21(15-17-25)24(27)31-18-6-9-19-7-4-3-5-8-19/h3-13,21H,2,14-18H2,1H3/b9-6+