4-[1-(4-methoxyphenyl)sulfonyl-2-(oxidanylcarbamoyl)piperidin-4-yl]carbonylpiperazine-1-carboxylic acid

Systemtic Name: 4-[1-(4-methoxyphenyl)sulfonyl-2-(oxidanylcarbamoyl)piperidin-4-yl]carbonylpiperazine-1-carboxylic acid Openeye Name: 4-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carbonyl]piperazine-1-carboxylic acid CAS Name: 4-[[2-[(hydroxyamino)-oxomethyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotoyl]piperazine-1-carboxylic acid Formula: C19H26N4O8S MolecularWeight: 470.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2C(=O)NO)C(=O)N3CCN(CC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2C(=O)NO)C(=O)N3CCN(CC3)C(=O)O

InChI

InChI=1S/C19H26N4O8S/c1-31-14-2-4-15(5-3-14)32(29,30)23-7-6-13(12-16(23)17(24)20-28)18(25)21-8-10-22(11-9-21)19(26)27/h2-5,13,16,28H,6-12H2,1H3,(H,20,24)(H,26,27)