3-[[[3-methoxy-4-(3-methylbutoxy)phenyl]carbonylamino]sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[[[3-methoxy-4-(3-methylbutoxy)phenyl]carbonylamino]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[(4-isopentyloxy-3-methoxy-benzoyl)amino]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[[[3-methoxy-4-(3-methylbutoxy)phenyl]-oxomethyl]amino]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[[3-methoxy-4-(3-methylbutoxy)benzoyl]amino]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[(4-isoamoxy-3-methoxy-benzoyl)amino]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C22H28N2O7S MolecularWeight: 464.53192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC(=O)C2=CC(=C(C=C2)OCCC(C)C)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC(=O)C2=CC(=C(C=C2)OCCC(C)C)OC)C

InChI

InChI=1S/C22H28N2O7S/c1-13(2)8-9-31-18-7-6-16(11-19(18)30-5)21(25)23-24-32(28,29)20-12-17(22(26)27)10-14(3)15(20)4/h6-7,10-13,24H,8-9H2,1-5H3,(H,23,25)(H,26,27)