4-[(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)sulfamoylcarbonyl]benzoic acid

Systemtic Name: 4-[(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)sulfamoylcarbonyl]benzoic acid Openeye Name: 4-[(1,1-dimethyl-4-oxo-tetralin-6-yl)sulfamoylcarbonyl]benzoic acid CAS Name: 4-[(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)sulfamoyl-oxomethyl]benzoic acid IUPAC Name: 4-[(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)sulfamoylcarbonyl]benzoic acid Traditional Name: 4-[(4-keto-1,1-dimethyl-tetralin-6-yl)sulfamoylcarbonyl]benzoic acid Formula: C20H19NO6S MolecularWeight: 401.43296

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C2=C1C=CC(=C2)NS(=O)(=O)C(=O)C3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1(CCC(=O)C2=C1C=CC(=C2)NS(=O)(=O)C(=O)C3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C20H19NO6S/c1-20(2)10-9-17(22)15-11-14(7-8-16(15)20)21-28(26,27)19(25)13-5-3-12(4-6-13)18(23)24/h3-8,11,21H,9-10H2,1-2H3,(H,23,24)