6-[[4-[butyl(methyl)sulfamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[4-[butyl(methyl)sulfamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[4-[butyl(methyl)sulfamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[4-[butyl(methyl)sulfamoyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[4-[butyl(methyl)sulfamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[4-[butyl(methyl)sulfamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)O

InChI

InChI=1S/C19H26N2O5S/c1-3-4-13-21(2)27(25,26)15-11-9-14(10-12-15)20-18(22)16-7-5-6-8-17(16)19(23)24/h5-6,9-12,16-17H,3-4,7-8,13H2,1-2H3,(H,20,22)(H,23,24)