4-methyl-3-[octyl-(phenylmethyl)amino]pentanoic acid

Systemtic Name: 4-methyl-3-[octyl-(phenylmethyl)amino]pentanoic acid Openeye Name: 3-[benzyl(octyl)amino]-4-methyl-pentanoic acid CAS Name: 4-methyl-3-[octyl-(phenylmethyl)amino]pentanoic acid IUPAC Name: 3-[benzyl(octyl)amino]-4-methylpentanoic acid Traditional Name: 3-[benzyl(octyl)amino]-4-methyl-valeric acid Formula: C21H35NO2 MolecularWeight: 333.5081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC1=CC=CC=C1)C(CC(=O)O)C(C)C

Isomeric SMILES

CCCCCCCCN(CC1=CC=CC=C1)C(CC(=O)O)C(C)C

InChI

InChI=1S/C21H35NO2/c1-4-5-6-7-8-12-15-22(17-19-13-10-9-11-14-19)20(18(2)3)16-21(23)24/h9-11,13-14,18,20H,4-8,12,15-17H2,1-3H3,(H,23,24)