4-(dimethylamino)butyl 2-(2-oxidanylidenebutyl)octadecyl hydrogen phosphate

Systemtic Name: 4-(dimethylamino)butyl 2-(2-oxidanylidenebutyl)octadecyl hydrogen phosphate Openeye Name: 4-(dimethylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate CAS Name: 4-(dimethylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate IUPAC Name: 4-(dimethylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate Traditional Name: 4-(dimethylamino)butyl 2-(2-ketobutyl)octadecyl hydrogen phosphate Formula: C28H58NO5P MolecularWeight: 519.737581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCCN(C)C

InChI

InChI=1S/C28H58NO5P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27(25-28(30)6-2)26-34-35(31,32)33-24-21-20-23-29(3)4/h27H,5-26H2,1-4H3,(H,31,32)