3-(methylamino)propyl 2-(2-oxidanylidenepentyl)icosyl hydrogen phosphate

Systemtic Name: 3-(methylamino)propyl 2-(2-oxidanylidenepentyl)icosyl hydrogen phosphate Openeye Name: 3-(methylamino)propyl 2-(2-oxopentyl)icosyl hydrogen phosphate CAS Name: 3-(methylamino)propyl 2-(2-oxopentyl)eicosyl hydrogen phosphate IUPAC Name: 3-(methylamino)propyl 2-(2-oxopentyl)icosyl hydrogen phosphate Traditional Name: 2-(2-ketopentyl)eicosyl 3-(methylamino)propyl hydrogen phosphate Formula: C29H60NO5P MolecularWeight: 533.764161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCNC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCNC

InChI

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