methyl 1-[(1-methyl-4-piperidin-1-ylsulfonyl-pyrrol-2-yl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(1-methyl-4-piperidin-1-ylsulfonyl-pyrrol-2-yl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(1-methyl-4-piperidinosulfonyl-pyrrole-2-carbonyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2(CCCCC2)C(=O)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2(CCCCC2)C(=O)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H29N3O5S/c1-21-14-15(28(25,26)22-11-7-4-8-12-22)13-16(21)17(23)20-19(18(24)27-2)9-5-3-6-10-19/h13-14H,3-12H2,1-2H3,(H,20,23)