2-[(4-dimethylaminophenyl)sulfonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(4-dimethylaminophenyl)sulfonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(4-dimethylaminophenyl)sulfonylamino]-4-methyl-pentanoic acid CAS Name: 2-[(4-dimethylaminophenyl)sulfonylamino]-4-methylpentanoic acid IUPAC Name: 2-[(4-dimethylaminophenyl)sulfonylamino]-4-methylpentanoic acid Traditional Name: 2-[(4-dimethylaminophenyl)sulfonylamino]-4-methyl-valeric acid Formula: C14H22N2O4S MolecularWeight: 314.40048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)N(C)C

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)N(C)C

InChI

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