2,4,8-tris(2-methylbutan-2-yl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide

Systemtic Name: 2,4,8-tris(2-methylbutan-2-yl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide Openeye Name: 2,4,8-tris(1,1-dimethylpropyl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide CAS Name: 2,4,8-tris(2-methylbutan-2-yl)benzo[c][1,2]benzoxaphosphorin-6-ium 6-oxide IUPAC Name: 2,4,8-tris(2-methylbutan-2-yl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide Traditional Name: 2,4,8-tritert-amylbenzo[c][1,2]benzoxaphosphorin-6-ium 6-oxide Formula: C27H38O2P+ MolecularWeight: 425.563181

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)C3=CC(=CC(=C3O[P+]2=O)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)C3=CC(=CC(=C3O[P+]2=O)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C27H38O2P/c1-10-25(4,5)18-13-14-20-21-15-19(26(6,7)11-2)16-22(27(8,9)12-3)24(21)29-30(28)23(20)17-18/h13-17H,10-12H2,1-9H3/q+1