methyl 2-[4-[cyclohexyl(methyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[cyclohexyl(methyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[cyclohexyl(methyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[cyclohexyl(methyl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[cyclohexyl(methyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[cyclohexyl(methyl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H30N2O5S/c1-22(17-8-4-3-5-9-17)20(24)16-12-14-23(15-13-16)29(26,27)19-11-7-6-10-18(19)21(25)28-2/h6-7,10-11,16-17H,3-5,8-9,12-15H2,1-2H3