4-[[3-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[3-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[2-hydroxy-1-[[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]phenyl]methyl]-2-oxo-ethyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[[1-hydroxy-3-[4-[(2-methyl-5-nitrophenyl)sulfonylamino]phenyl]-1-oxopropan-2-yl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[1-hydroxy-3-[4-[(2-methyl-5-nitrophenyl)sulfonylamino]phenyl]-1-oxopropan-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[2-hydroxy-2-keto-1-[4-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzyl]ethyl]carbamoyl]cyclohexanecarboxylic acid Formula: C24H27N3O9S MolecularWeight: 533.55088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3CCC(CC3)C(=O)O

InChI

InChI=1S/C24H27N3O9S/c1-14-2-11-19(27(33)34)13-21(14)37(35,36)26-18-9-3-15(4-10-18)12-20(24(31)32)25-22(28)16-5-7-17(8-6-16)23(29)30/h2-4,9-11,13,16-17,20,26H,5-8,12H2,1H3,(H,25,28)(H,29,30)(H,31,32)