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

Systemtic Name: 3-(dimethylamino)propyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate Openeye Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate CAS Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate IUPAC Name: 3-(dimethylamino)propyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate Traditional Name: 3-(dimethylamino)propyl [4-keto-2-(4-myristyloxybenzyl)pentyl] hydrogen phosphate Formula: C31H56NO6P MolecularWeight: 569.753201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H56NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-23-36-31-20-18-29(19-21-31)26-30(25-28(2)33)27-38-39(34,35)37-24-17-22-32(3)4/h18-21,30H,5-17,22-27H2,1-4H3,(H,34,35)