methyl 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(3,4-dimethoxyphenyl)sulfonylisonipecotoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C22H32N2O7S MolecularWeight: 468.56368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC)OC

InChI

InChI=1S/C22H32N2O7S/c1-29-18-8-7-17(15-19(18)30-2)32(27,28)24-13-9-16(10-14-24)20(25)23-22(21(26)31-3)11-5-4-6-12-22/h7-8,15-16H,4-6,9-14H2,1-3H3,(H,23,25)