methyl 1-[4-(phenylsulfonylaminomethyl)cyclohexyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(phenylsulfonylaminomethyl)cyclohexyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]piperidine-4-carboxylate CAS Name: 1-[[4-(benzenesulfonamidomethyl)cyclohexyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]piperidine-4-carboxylate Traditional Name: 1-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]isonipecotic acid methyl ester Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H30N2O5S/c1-28-21(25)18-11-13-23(14-12-18)20(24)17-9-7-16(8-10-17)15-22-29(26,27)19-5-3-2-4-6-19/h2-6,16-18,22H,7-15H2,1H3