tributyl-[(3-propoxycarbonylphenyl)methyl]phosphanium bromide

Systemtic Name: tributyl-[(3-propoxycarbonylphenyl)methyl]phosphanium bromide Openeye Name: tributyl-[(3-propoxycarbonylphenyl)methyl]phosphonium bromide CAS Name: tributyl-[[3-[oxo(propoxy)methyl]phenyl]methyl]phosphonium bromide IUPAC Name: tributyl-[(3-propoxycarbonylphenyl)methyl]phosphanium bromide Traditional Name: tributyl-(3-propoxycarbonylbenzyl)phosphonium bromide Formula: C23H40BrO2P MolecularWeight: 459.440261

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CC1=CC=CC(=C1)C(=O)OCCC.[Br-]

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CC1=CC=CC(=C1)C(=O)OCCC.[Br-]

InChI

InChI=1S/C23H40O2P.BrH/c1-5-9-16-26(17-10-6-2,18-11-7-3)20-21-13-12-14-22(19-21)23(24)25-15-8-4;/h12-14,19H,5-11,15-18,20H2,1-4H3;1H/q+1;/p-1