3-[2-cyanoethyl(propan-2-yl)sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[2-cyanoethyl(propan-2-yl)sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[2-cyanoethyl(isopropyl)sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[2-cyanoethyl(propan-2-yl)sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[2-cyanoethyl(propan-2-yl)sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[2-cyanoethyl(isopropyl)sulfamoyl]-4-methyl-benzoic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(CCC#N)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(CCC#N)C(C)C

InChI

InChI=1S/C14H18N2O4S/c1-10(2)16(8-4-7-15)21(19,20)13-9-12(14(17)18)6-5-11(13)3/h5-6,9-10H,4,8H2,1-3H3,(H,17,18)