2-[[3-(dimethylsulfamoyl)phenyl]methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[3-(dimethylsulfamoyl)phenyl]methylamino]-3-methyl-butanoic acid Openeye Name: 2-[[3-(dimethylsulfamoyl)phenyl]methylamino]-3-methyl-butanoic acid CAS Name: 2-[[3-(dimethylsulfamoyl)phenyl]methylamino]-3-methylbutanoic acid IUPAC Name: 2-[[3-(dimethylsulfamoyl)phenyl]methylamino]-3-methylbutanoic acid Traditional Name: 2-[[3-(dimethylsulfamoyl)benzyl]amino]-3-methyl-butyric acid Formula: C14H22N2O4S MolecularWeight: 314.40048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CC(=CC=C1)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CC(=CC=C1)S(=O)(=O)N(C)C

InChI

InChI=1S/C14H22N2O4S/c1-10(2)13(14(17)18)15-9-11-6-5-7-12(8-11)21(19,20)16(3)4/h5-8,10,13,15H,9H2,1-4H3,(H,17,18)