(3S,5R)-3-azanyl-5-methyl-octanoic acid

Systemtic Name: (3S,5R)-3-azanyl-5-methyl-octanoic acid Openeye Name: (3S,5R)-3-amino-5-methyl-octanoic acid CAS Name: (3S,5R)-3-amino-5-methyloctanoic acid IUPAC Name: (3S,5R)-3-amino-5-methyloctanoic acid Traditional Name: (3S,5R)-3-amino-5-methyl-caprylic acid Formula: C9H19NO2 MolecularWeight: 173.25266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(CC(=O)O)N

Isomeric SMILES

CCC[C@@H](C)C[C@@H](CC(=O)O)N

InChI

InChI=1S/C9H19NO2/c1-3-4-7(2)5-8(10)6-9(11)12/h7-8H,3-6,10H2,1-2H3,(H,11,12)/t7-,8+/m1/s1