cyclohexylmethyl 1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: cyclohexylmethyl 1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: cyclohexylmethyl 1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonylisonipecotic acid cyclohexylmethyl ester Formula: C21H31NO6S MolecularWeight: 425.53894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3CCCCC3)OC

InChI

InChI=1S/C21H31NO6S/c1-26-19-9-8-18(14-20(19)27-2)29(24,25)22-12-10-17(11-13-22)21(23)28-15-16-6-4-3-5-7-16/h8-9,14,16-17H,3-7,10-13,15H2,1-2H3