2-dimethylaminoethyl [4-oxidanylidene-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate

Systemtic Name: 2-dimethylaminoethyl [4-oxidanylidene-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate Openeye Name: 2-dimethylaminoethyl [4-oxo-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate CAS Name: 2-dimethylaminoethyl [4-oxo-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate IUPAC Name: 2-dimethylaminoethyl [4-oxo-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate Traditional Name: 2-dimethylaminoethyl [4-keto-2-[2-(4-undecoxyphenyl)ethyl]pentyl] hydrogen phosphate Formula: C28H50NO6P MolecularWeight: 527.673461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H50NO6P/c1-5-6-7-8-9-10-11-12-13-21-33-28-18-16-26(17-19-28)14-15-27(23-25(2)30)24-35-36(31,32)34-22-20-29(3)4/h16-19,27H,5-15,20-24H2,1-4H3,(H,31,32)