2-[(4-ethylphenyl)methyl-methyl-sulfamoyl]ethanoic acid

Systemtic Name: 2-[(4-ethylphenyl)methyl-methyl-sulfamoyl]ethanoic acid Openeye Name: 2-[(4-ethylphenyl)methyl-methyl-sulfamoyl]acetic acid CAS Name: 2-[(4-ethylphenyl)methyl-methylsulfamoyl]acetic acid IUPAC Name: 2-[(4-ethylphenyl)methyl-methylsulfamoyl]acetic acid Traditional Name: 2-[(4-ethylbenzyl)-methyl-sulfamoyl]acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)S(=O)(=O)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-3-10-4-6-11(7-5-10)8-13(2)18(16,17)9-12(14)15/h4-7H,3,8-9H2,1-2H3,(H,14,15)