2-azanyl-4-methyl-pentanoic acid; (3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)-dimethyl-sulfanium

Systemtic Name: 2-azanyl-4-methyl-pentanoic acid; (3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)-dimethyl-sulfanium Openeye Name: (3-amino-4-hydroxy-4-oxo-butyl)-dimethyl-sulfonium; 2-amino-4-methyl-pentanoic acid CAS Name: (3-amino-4-hydroxy-4-oxobutyl)-dimethylsulfonium; 2-amino-4-methylpentanoic acid IUPAC Name: (3-amino-4-hydroxy-4-oxobutyl)-dimethylsulfanium; 2-amino-4-methylpentanoic acid Traditional Name: (3-amino-4-hydroxy-4-keto-butyl)-dimethyl-sulfonium; 2-amino-4-methyl-valeric acid Formula: C12H27N2O4S+ MolecularWeight: 295.41878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N.C[S+](C)CCC(C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)O)N.C[S+](C)CCC(C(=O)O)N

InChI

InChI=1S/C6H13NO2S.C6H13NO2/c1-10(2)4-3-5(7)6(8)9;1-4(2)3-5(7)6(8)9/h5H,3-4,7H2,1-2H3;4-5H,3,7H2,1-2H3,(H,8,9)/p+1