2-[ethyl(2-methylprop-2-enyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 2-[ethyl(2-methylprop-2-enyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 2-[ethyl(2-methylallyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 2-[ethyl(2-methylprop-2-enyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 2-[ethyl(2-methylprop-2-enyl)amino]-5-sulfamoylbenzoic acid Traditional Name: 2-[ethyl(2-methylallyl)amino]-5-sulfamoyl-benzoic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CCN(CC(=C)C)C1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C13H18N2O4S/c1-4-15(8-9(2)3)12-6-5-10(20(14,18)19)7-11(12)13(16)17/h5-7H,2,4,8H2,1,3H3,(H,16,17)(H2,14,18,19)