2-(methylamino)ethyl 2-(2-oxidanylidenepentyl)henicosyl hydrogen phosphate

Systemtic Name: 2-(methylamino)ethyl 2-(2-oxidanylidenepentyl)henicosyl hydrogen phosphate Openeye Name: 2-(methylamino)ethyl 2-(2-oxopentyl)henicosyl hydrogen phosphate CAS Name: 2-(methylamino)ethyl 2-(2-oxopentyl)heneicosyl hydrogen phosphate IUPAC Name: 2-(methylamino)ethyl 2-(2-oxopentyl)henicosyl hydrogen phosphate Traditional Name: 2-(2-ketopentyl)heneicosyl 2-(methylamino)ethyl hydrogen phosphate Formula: C29H60NO5P MolecularWeight: 533.764161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCNC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCNC

InChI

InChI=1S/C29H60NO5P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-28(26-29(31)22-5-2)27-35-36(32,33)34-25-24-30-3/h28,30H,4-27H2,1-3H3,(H,32,33)