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

Systemtic Name: 1-[2-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[3-[(4-methoxyphenyl)sulfamoyl]anilino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[3-[(4-methoxyphenyl)sulfamoyl]anilino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[3-[(4-methoxyphenyl)sulfamoyl]anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[3-[(4-methoxyphenyl)sulfamoyl]anilino]ethyl]cycloheptanecarboxylic acid Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3(CCCCCC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3(CCCCCC3)C(=O)O

InChI

InChI=1S/C23H28N2O6S/c1-31-19-11-9-17(10-12-19)25-32(29,30)20-8-6-7-18(15-20)24-21(26)16-23(22(27)28)13-4-2-3-5-14-23/h6-12,15,25H,2-5,13-14,16H2,1H3,(H,24,26)(H,27,28)