ethyl 4-[4-[1-[4-(phenylsulfinyl)phenyl]ethenyl]piperidin-1-yl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[4-[1-[4-(phenylsulfinyl)phenyl]ethenyl]piperidin-1-yl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[4-[1-[4-(benzenesulfinyl)phenyl]vinyl]-1-piperidyl]cyclohexanecarboxylate CAS Name: 4-[4-[1-[4-(benzenesulfinyl)phenyl]ethenyl]-1-piperidinyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-[4-(benzenesulfinyl)phenyl]ethenyl]piperidin-1-yl]cyclohexane-1-carboxylate Traditional Name: 4-[4-[1-[4-(benzenesulfinyl)phenyl]vinyl]piperidino]cyclohexanecarboxylic acid ethyl ester Formula: C28H35NO3S MolecularWeight: 465.6474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)N2CCC(CC2)C(=C)C3=CC=C(C=C3)S(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCC(CC1)N2CCC(CC2)C(=C)C3=CC=C(C=C3)S(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H35NO3S/c1-3-32-28(30)24-9-13-25(14-10-24)29-19-17-23(18-20-29)21(2)22-11-15-27(16-12-22)33(31)26-7-5-4-6-8-26/h4-8,11-12,15-16,23-25H,2-3,9-10,13-14,17-20H2,1H3