2-bromoethyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]pentyl] phosphate

Systemtic Name: 2-bromoethyl [4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]pentyl] phosphate Openeye Name: 2-bromoethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] phosphate CAS Name: 2-bromoethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] phosphate IUPAC Name: 2-bromoethyl [4-oxo-2-[(4-tetradecoxyphenyl)methyl]pentyl] phosphate Traditional Name: 2-bromoethyl [4-keto-2-(4-myristyloxybenzyl)pentyl] phosphate Formula: C28H47BrO6P- MolecularWeight: 590.546941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)([O-])OCCBr

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)([O-])OCCBr

InChI

InChI=1S/C28H48BrO6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-33-28-17-15-26(16-18-28)23-27(22-25(2)30)24-35-36(31,32)34-21-19-29/h15-18,27H,3-14,19-24H2,1-2H3,(H,31,32)/p-1