ethyl 1-[(2,5-dimethyl-4-piperidin-1-ylcarbonyl-1H-pyrrol-3-yl)sulfonyl]piperidine-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(NC(=C2C(=O)N3CCCCC3)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(NC(=C2C(=O)N3CCCCC3)C)C

InChI

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