3-(dimethylamino)propyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]heptyl] hydrogen phosphate

Systemtic Name: 3-(dimethylamino)propyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]heptyl] hydrogen phosphate Openeye Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]heptyl] hydrogen phosphate CAS Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]heptyl] hydrogen phosphate IUPAC Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]heptyl] hydrogen phosphate Traditional Name: 3-(dimethylamino)propyl [4-keto-2-(4-myristyloxybenzyl)heptyl] hydrogen phosphate Formula: C33H60NO6P MolecularWeight: 597.806361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)CCC)COP(=O)(O)OCCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)CCC)COP(=O)(O)OCCCN(C)C

InChI

InChI=1S/C33H60NO6P/c1-5-7-8-9-10-11-12-13-14-15-16-17-25-38-33-22-20-30(21-23-33)27-31(28-32(35)19-6-2)29-40-41(36,37)39-26-18-24-34(3)4/h20-23,31H,5-19,24-29H2,1-4H3,(H,36,37)