(2R)-2-[(2-hydroxyphenyl)methylazaniumyl]-4-methyl-pentanoate

Systemtic Name: (2R)-2-[(2-hydroxyphenyl)methylazaniumyl]-4-methyl-pentanoate Openeye Name: (2R)-2-[(2-hydroxyphenyl)methylammonio]-4-methyl-pentanoate CAS Name: (2R)-2-[(2-hydroxyphenyl)methylammonio]-4-methylpentanoate IUPAC Name: (2R)-2-[(2-hydroxyphenyl)methylazaniumyl]-4-methylpentanoate Traditional Name: (2R)-4-methyl-2-(salicylammonio)valerate Formula: C13H19NO3 MolecularWeight: 237.29486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])[NH2+]CC1=CC=CC=C1O

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])[NH2+]CC1=CC=CC=C1O

InChI

InChI=1S/C13H19NO3/c1-9(2)7-11(13(16)17)14-8-10-5-3-4-6-12(10)15/h3-6,9,11,14-15H,7-8H2,1-2H3,(H,16,17)/t11-/m1/s1