2-(methylamino)ethyl [4-oxidanylidene-2-[2-(4-undecoxyphenyl)ethyl]heptyl] hydrogen phosphate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=C(C=C1)CCC(CC(=O)CCC)COP(=O)(O)OCCNC

Isomeric SMILES

CCCCCCCCCCCOC1=CC=C(C=C1)CCC(CC(=O)CCC)COP(=O)(O)OCCNC

InChI

InChI=1S/C29H52NO6P/c1-4-6-7-8-9-10-11-12-13-22-34-29-19-17-26(18-20-29)15-16-27(24-28(31)14-5-2)25-36-37(32,33)35-23-21-30-3/h17-20,27,30H,4-16,21-25H2,1-3H3,(H,32,33)