sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-oxidanylidene-nonadecanoic acid

Systemtic Name: sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-oxidanylidene-nonadecanoic acid Openeye Name: sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-oxo-nonadecanoic acid CAS Name: sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-oxononadecanoic acid IUPAC Name: sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-oxononadecanoic acid Traditional Name: sodium 19-[2-[carboxymethyl(2-hydroxyethyl)amino]ethylamino]-19-keto-nonadecanoic acid Formula: C25H48N2NaO6+ MolecularWeight: 495.64819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCC(=O)NCCN(CCO)CC(=O)O)CCCCCCCCC(=O)O.[Na+]

Isomeric SMILES

C(CCCCCCCCC(=O)NCCN(CCO)CC(=O)O)CCCCCCCCC(=O)O.[Na+]

InChI

InChI=1S/C25H48N2O6.Na/c28-21-20-27(22-25(32)33)19-18-26-23(29)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-24(30)31;/h28H,1-22H2,(H,26,29)(H,30,31)(H,32,33);/q;+1