4-[[(3-chloranyl-4-methoxy-phenyl)methyl-(5-methyl-2-sulfamoyl-phenyl)carbonyl-amino]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(3-chloranyl-4-methoxy-phenyl)methyl-(5-methyl-2-sulfamoyl-phenyl)carbonyl-amino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(3-chloro-4-methoxy-phenyl)methyl-(5-methyl-2-sulfamoyl-benzoyl)amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[2-[(3-chloro-4-methoxyphenyl)methyl]-2-[(5-methyl-2-sulfamoylphenyl)-oxomethyl]hydrazinyl]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(3-chloro-4-methoxyphenyl)methyl-(5-methyl-2-sulfamoylbenzoyl)amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(3-chloro-4-methoxy-benzyl)-(5-methyl-2-sulfamoyl-benzoyl)amino]carbamoyl]cyclohexanecarboxylic acid Formula: C24H28ClN3O7S MolecularWeight: 538.01302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N)C(=O)N(CC2=CC(=C(C=C2)OC)Cl)NC(=O)C3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N)C(=O)N(CC2=CC(=C(C=C2)OC)Cl)NC(=O)C3CCC(CC3)C(=O)O

InChI

InChI=1S/C24H28ClN3O7S/c1-14-3-10-21(36(26,33)34)18(11-14)23(30)28(13-15-4-9-20(35-2)19(25)12-15)27-22(29)16-5-7-17(8-6-16)24(31)32/h3-4,9-12,16-17H,5-8,13H2,1-2H3,(H,27,29)(H,31,32)(H2,26,33,34)