2-(methylamino)ethyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate

Systemtic Name: 2-(methylamino)ethyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate Openeye Name: 2-(methylamino)ethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate CAS Name: 2-(methylamino)ethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate IUPAC Name: 2-(methylamino)ethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] hydrogen phosphate Traditional Name: [4-keto-2-(4-myristyloxybenzyl)pentyl] 2-(methylamino)ethyl hydrogen phosphate Formula: C29H52NO6P MolecularWeight: 541.700041

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H52NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-21-34-29-18-16-27(17-19-29)24-28(23-26(2)31)25-36-37(32,33)35-22-20-30-3/h16-19,28,30H,4-15,20-25H2,1-3H3,(H,32,33)