5-(hexylamino)-2-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(hexylamino)-2-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-(hexylamino)-2-methyl-5-oxo-pentanoic acid CAS Name: 5-(hexylamino)-2-methyl-5-oxopentanoic acid IUPAC Name: 5-(hexylamino)-2-methyl-5-oxopentanoic acid Traditional Name: 5-(hexylamino)-5-keto-2-methyl-valeric acid Formula: C12H23NO3 MolecularWeight: 229.31592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCC(C)C(=O)O

Isomeric SMILES

CCCCCCNC(=O)CCC(C)C(=O)O

InChI

InChI=1S/C12H23NO3/c1-3-4-5-6-9-13-11(14)8-7-10(2)12(15)16/h10H,3-9H2,1-2H3,(H,13,14)(H,15,16)