2-(methylamino)ethyl [2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-hexyl] hydrogen phosphate

Systemtic Name: 2-(methylamino)ethyl [2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-hexyl] hydrogen phosphate Openeye Name: 2-(methylamino)ethyl [2-[(2-octadecoxyphenyl)methyl]-4-oxo-hexyl] hydrogen phosphate CAS Name: 2-(methylamino)ethyl [2-[(2-octadecoxyphenyl)methyl]-4-oxohexyl] hydrogen phosphate IUPAC Name: 2-(methylamino)ethyl [2-[(2-octadecoxyphenyl)methyl]-4-oxohexyl] hydrogen phosphate Traditional Name: [4-keto-2-(2-stearyloxybenzyl)hexyl] 2-(methylamino)ethyl hydrogen phosphate Formula: C34H62NO6P MolecularWeight: 611.832941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)CC)COP(=O)(O)OCCNC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)CC)COP(=O)(O)OCCNC

InChI

InChI=1S/C34H62NO6P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-39-34-24-21-20-23-32(34)28-31(29-33(36)5-2)30-41-42(37,38)40-27-25-35-3/h20-21,23-24,31,35H,4-19,22,25-30H2,1-3H3,(H,37,38)