5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid

Systemtic Name: 5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid Openeye Name: 5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid CAS Name: 5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid IUPAC Name: 5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid Traditional Name: 5-(methylamino)-4-[[(E)-octadec-9-enyl]amino]hexanoic acid Formula: C25H50N2O2 MolecularWeight: 410.6767

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC(CCC(=O)O)C(C)NC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC(CCC(=O)O)C(C)NC

InChI

InChI=1S/C25H50N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27-24(23(2)26-3)20-21-25(28)29/h11-12,23-24,26-27H,4-10,13-22H2,1-3H3,(H,28,29)/b12-11+