4-(methylamino)butyl 2-(2-oxidanylidenepentyl)octadecyl hydrogen phosphate

Systemtic Name: 4-(methylamino)butyl 2-(2-oxidanylidenepentyl)octadecyl hydrogen phosphate Openeye Name: 4-(methylamino)butyl 2-(2-oxopentyl)octadecyl hydrogen phosphate CAS Name: 4-(methylamino)butyl 2-(2-oxopentyl)octadecyl hydrogen phosphate IUPAC Name: 4-(methylamino)butyl 2-(2-oxopentyl)octadecyl hydrogen phosphate Traditional Name: 2-(2-ketopentyl)octadecyl 4-(methylamino)butyl hydrogen phosphate Formula: C28H58NO5P MolecularWeight: 519.737581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCCNC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCCNC

InChI

InChI=1S/C28H58NO5P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-27(25-28(30)21-5-2)26-34-35(31,32)33-24-20-19-23-29-3/h27,29H,4-26H2,1-3H3,(H,31,32)