6-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbonylamino]hexanoic acid Openeye Name: 6-[[1-(4-acetamidophenyl)sulfonylpiperidine-4-carbonyl]amino]hexanoic acid CAS Name: 6-[[[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[1-(4-acetamidophenyl)sulfonylpiperidine-4-carbonyl]amino]hexanoic acid Traditional Name: 6-[[1-(4-acetamidophenyl)sulfonylisonipecotoyl]amino]hexanoic acid Formula: C20H29N3O6S MolecularWeight: 439.52576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCCCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C20H29N3O6S/c1-15(24)22-17-6-8-18(9-7-17)30(28,29)23-13-10-16(11-14-23)20(27)21-12-4-2-3-5-19(25)26/h6-9,16H,2-5,10-14H2,1H3,(H,21,27)(H,22,24)(H,25,26)