2-dimethylaminoethyl [2-[3-(4-dodecoxyphenyl)propyl]-4-oxidanylidene-pentyl] hydrogen phosphate

Systemtic Name: 2-dimethylaminoethyl [2-[3-(4-dodecoxyphenyl)propyl]-4-oxidanylidene-pentyl] hydrogen phosphate Openeye Name: 2-dimethylaminoethyl [2-[3-(4-dodecoxyphenyl)propyl]-4-oxo-pentyl] hydrogen phosphate CAS Name: 2-dimethylaminoethyl [2-[3-(4-dodecoxyphenyl)propyl]-4-oxopentyl] hydrogen phosphate IUPAC Name: 2-dimethylaminoethyl [2-[3-(4-dodecoxyphenyl)propyl]-4-oxopentyl] hydrogen phosphate Traditional Name: 2-dimethylaminoethyl [4-keto-2-[3-(4-lauryloxyphenyl)propyl]pentyl] hydrogen phosphate Formula: C30H54NO6P MolecularWeight: 555.726621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H54NO6P/c1-5-6-7-8-9-10-11-12-13-14-23-35-30-20-18-28(19-21-30)16-15-17-29(25-27(2)32)26-37-38(33,34)36-24-22-31(3)4/h18-21,29H,5-17,22-26H2,1-4H3,(H,33,34)