ethyl 7-bromanyl-2-diphenylphosphoryl-heptanoate

Systemtic Name: ethyl 7-bromanyl-2-diphenylphosphoryl-heptanoate Openeye Name: ethyl 7-bromo-2-diphenylphosphoryl-heptanoate CAS Name: 7-bromo-2-diphenylphosphorylheptanoic acid ethyl ester IUPAC Name: ethyl 7-bromo-2-diphenylphosphorylheptanoate Traditional Name: 7-bromo-2-diphenylphosphoryl-enanthic acid ethyl ester Formula: C21H26BrO3P MolecularWeight: 437.307101

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCBr)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CCCCCBr)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H26BrO3P/c1-2-25-21(23)20(16-10-5-11-17-22)26(24,18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-4,6-9,12-15,20H,2,5,10-11,16-17H2,1H3