methyl 2-ethyl-4-propan-2-yl-5-sulfamoyl-benzoate

Systemtic Name: methyl 2-ethyl-4-propan-2-yl-5-sulfamoyl-benzoate Openeye Name: methyl 2-ethyl-4-isopropyl-5-sulfamoyl-benzoate CAS Name: 2-ethyl-4-propan-2-yl-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-ethyl-4-propan-2-yl-5-sulfamoylbenzoate Traditional Name: 2-ethyl-4-isopropyl-5-sulfamoyl-benzoic acid methyl ester Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)N)C(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)N)C(C)C

InChI

InChI=1S/C13H19NO4S/c1-5-9-6-10(8(2)3)12(19(14,16)17)7-11(9)13(15)18-4/h6-8H,5H2,1-4H3,(H2,14,16,17)