1-(1-methyl-5-morpholin-4-ylcarbonyl-pyrrol-3-yl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(1-methyl-5-morpholin-4-ylcarbonyl-pyrrol-3-yl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[1-methyl-5-(morpholine-4-carbonyl)pyrrol-3-yl]sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[[1-methyl-5-[4-morpholinyl(oxo)methyl]-3-pyrrolyl]sulfonyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-methyl-5-(morpholine-4-carbonyl)pyrrol-3-yl]sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[1-methyl-5-(morpholine-4-carbonyl)pyrrol-3-yl]sulfonylisonipecotic acid Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCOCC2)S(=O)(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCOCC2)S(=O)(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H23N3O6S/c1-17-11-13(10-14(17)15(20)18-6-8-25-9-7-18)26(23,24)19-4-2-12(3-5-19)16(21)22/h10-12H,2-9H2,1H3,(H,21,22)