disodium 3-[2-(dodecanoylamino)ethyl-[2-(3-oxidanidyl-3-oxidanylidene-propoxy)ethyl]amino]propanoate

Systemtic Name: disodium 3-[2-(dodecanoylamino)ethyl-[2-(3-oxidanidyl-3-oxidanylidene-propoxy)ethyl]amino]propanoate Openeye Name: disodium 3-[2-(dodecanoylamino)ethyl-[2-(3-oxido-3-oxo-propoxy)ethyl]amino]propanoate CAS Name: disodium 3-[2-(3-oxido-3-oxopropoxy)ethyl-[2-(1-oxododecylamino)ethyl]amino]propanoate IUPAC Name: disodium 3-[2-(dodecanoylamino)ethyl-[2-(3-oxido-3-oxopropoxy)ethyl]amino]propanoate Traditional Name: disodium 3-[2-(3-keto-3-oxido-propoxy)ethyl-[2-(lauroylamino)ethyl]amino]propionate Formula: C22H40N2Na2O6 MolecularWeight: 474.54234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCCN(CCC(=O)[O-])CCOCCC(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)NCCN(CCC(=O)[O-])CCOCCC(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C22H42N2O6.2Na/c1-2-3-4-5-6-7-8-9-10-11-20(25)23-14-16-24(15-12-21(26)27)17-19-30-18-13-22(28)29;;/h2-19H2,1H3,(H,23,25)(H,26,27)(H,28,29);;/q;2*+1/p-2