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

Systemtic Name: tributyl-[(3-methoxycarbonylphenyl)methyl]phosphanium bromide Openeye Name: tributyl-[(3-methoxycarbonylphenyl)methyl]phosphonium bromide CAS Name: tributyl-[(3-methoxycarbonylphenyl)methyl]phosphonium bromide IUPAC Name: tributyl-[(3-methoxycarbonylphenyl)methyl]phosphanium bromide Traditional Name: tributyl-(3-carbomethoxybenzyl)phosphonium bromide Formula: C21H36BrO2P MolecularWeight: 431.387101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H36O2P.BrH/c1-5-8-14-24(15-9-6-2,16-10-7-3)18-19-12-11-13-20(17-19)21(22)23-4;/h11-13,17H,5-10,14-16,18H2,1-4H3;1H/q+1;/p-1