2,8-ditert-butyl-4-(phenylmethyl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide

Systemtic Name: 2,8-ditert-butyl-4-(phenylmethyl)benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide Openeye Name: 4-benzyl-2,8-ditert-butyl-benzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide CAS Name: 2,8-ditert-butyl-4-(phenylmethyl)benzo[c][1,2]benzoxaphosphorin-6-ium 6-oxide IUPAC Name: 4-benzyl-2,8-ditert-butylbenzo[c][1,2]benzoxaphosphinin-6-ium 6-oxide Traditional Name: 4-benzyl-2,8-ditert-butyl-benzo[c][1,2]benzoxaphosphorin-6-ium 6-oxide Formula: C27H30O2P+ MolecularWeight: 417.499661

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C3=CC(=CC(=C3O[P+]2=O)CC4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C3=CC(=CC(=C3O[P+]2=O)CC4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C27H30O2P/c1-26(2,3)20-12-13-22-23-16-21(27(4,5)6)15-19(14-18-10-8-7-9-11-18)25(23)29-30(28)24(22)17-20/h7-13,15-17H,14H2,1-6H3/q+1