2-dimethylaminoethyl [2-[(4-dodecoxyphenyl)methyl]-4-oxidanylidene-pentyl] hydrogen phosphate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)(O)OCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)(O)OCCN(C)C

InChI

InChI=1S/C28H50NO6P/c1-5-6-7-8-9-10-11-12-13-14-20-33-28-17-15-26(16-18-28)23-27(22-25(2)30)24-35-36(31,32)34-21-19-29(3)4/h15-18,27H,5-14,19-24H2,1-4H3,(H,31,32)