ethyl 2,5-dimethyl-4-(3-piperidin-1-ylcarbonylpiperidin-1-yl)sulfonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-(3-piperidin-1-ylcarbonylpiperidin-1-yl)sulfonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[[3-(piperidine-1-carbonyl)-1-piperidyl]sulfonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[3-[oxo(1-piperidinyl)methyl]-1-piperidinyl]sulfonyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidino]sulfonyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)N3CCCCC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)N3CCCCC3)C)C

InChI

InChI=1S/C20H31N3O5S/c1-4-28-20(25)17-14(2)21-15(3)18(17)29(26,27)23-12-8-9-16(13-23)19(24)22-10-6-5-7-11-22/h16,21H,4-13H2,1-3H3