1-[2-[[3-[(4-bromophenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[[3-[(4-bromophenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-[3-[(4-bromophenyl)sulfamoyl]anilino]-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-[3-[(4-bromophenyl)sulfamoyl]anilino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-[3-[(4-bromophenyl)sulfamoyl]anilino]-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-[3-[(4-bromophenyl)sulfamoyl]anilino]-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C21H23BrN2O5S MolecularWeight: 495.38672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C21H23BrN2O5S/c22-15-7-9-16(10-8-15)24-30(28,29)18-6-4-5-17(13-18)23-19(25)14-21(20(26)27)11-2-1-3-12-21/h4-10,13,24H,1-3,11-12,14H2,(H,23,25)(H,26,27)