3-[3-(2-dimethylaminoethylsulfamoyl)-4-methyl-phenyl]propanoic acid

Systemtic Name: 3-[3-(2-dimethylaminoethylsulfamoyl)-4-methyl-phenyl]propanoic acid Openeye Name: 3-[3-(2-dimethylaminoethylsulfamoyl)-4-methyl-phenyl]propanoic acid CAS Name: 3-[3-(2-dimethylaminoethylsulfamoyl)-4-methylphenyl]propanoic acid IUPAC Name: 3-[3-(2-dimethylaminoethylsulfamoyl)-4-methylphenyl]propanoic acid Traditional Name: 3-[3-(2-dimethylaminoethylsulfamoyl)-4-methyl-phenyl]propionic acid Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)O)S(=O)(=O)NCCN(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)O)S(=O)(=O)NCCN(C)C

InChI

InChI=1S/C14H22N2O4S/c1-11-4-5-12(6-7-14(17)18)10-13(11)21(19,20)15-8-9-16(2)3/h4-5,10,15H,6-9H2,1-3H3,(H,17,18)