3-[3-(dimethylsulfamoyl)-4-methyl-phenyl]propanoate

Systemtic Name: 3-[3-(dimethylsulfamoyl)-4-methyl-phenyl]propanoate Openeye Name: 3-[3-(dimethylsulfamoyl)-4-methyl-phenyl]propanoate CAS Name: 3-[3-(dimethylsulfamoyl)-4-methylphenyl]propanoate IUPAC Name: 3-[3-(dimethylsulfamoyl)-4-methylphenyl]propanoate Traditional Name: 3-[3-(dimethylsulfamoyl)-4-methyl-phenyl]propionate Formula: C12H16NO4S- MolecularWeight: 270.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)[O-])S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)[O-])S(=O)(=O)N(C)C

InChI

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