[1-[(E)-2-(4-methylsulfonylphenyl)-1-phenyl-ethenyl]piperidin-4-yl] 2-methylprop-2-enoate

Systemtic Name: [1-[(E)-2-(4-methylsulfonylphenyl)-1-phenyl-ethenyl]piperidin-4-yl] 2-methylprop-2-enoate Openeye Name: [1-[(E)-2-(4-methylsulfonylphenyl)-1-phenyl-vinyl]-4-piperidyl] 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [1-[(E)-2-(4-methylsulfonylphenyl)-1-phenylethenyl]-4-piperidinyl] ester IUPAC Name: [1-[(E)-2-(4-methylsulfonylphenyl)-1-phenylethenyl]piperidin-4-yl] 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [1-[(E)-2-(4-mesylphenyl)-1-phenyl-vinyl]-4-piperidyl] ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OC1CCN(CC1)C(=CC2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(=C)C(=O)OC1CCN(CC1)/C(=C/C2=CC=C(C=C2)S(=O)(=O)C)/C3=CC=CC=C3

InChI

InChI=1S/C24H27NO4S/c1-18(2)24(26)29-21-13-15-25(16-14-21)23(20-7-5-4-6-8-20)17-19-9-11-22(12-10-19)30(3,27)28/h4-12,17,21H,1,13-16H2,2-3H3/b23-17+