bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methyl-phenoxy]-oxidanylidene-phosphanium

Systemtic Name: bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methyl-phenoxy]-oxidanylidene-phosphanium Openeye Name: bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methyl-phenoxy]-oxo-phosphonium CAS Name: bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methylphenoxy]-oxophosphonium IUPAC Name: bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methylphenoxy]-oxophosphanium Traditional Name: bis[3-[6-(4-butylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-methyl-phenoxy]-keto-phosphonium Formula: C42H50N4O3P+ MolecularWeight: 689.845161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NN(CCC2)C3=C(C(=CC=C3)O[P+](=O)OC4=CC=CC(=C4C)N5CCCC(=N5)C6=CC=C(C=C6)CCCC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NN(CCC2)C3=C(C(=CC=C3)O[P+](=O)OC4=CC=CC(=C4C)N5CCCC(=N5)C6=CC=C(C=C6)CCCC)C

InChI

InChI=1S/C42H50N4O3P/c1-5-7-13-33-21-25-35(26-22-33)37-15-11-29-45(43-37)39-17-9-19-41(31(39)3)48-50(47)49-42-20-10-18-40(32(42)4)46-30-12-16-38(44-46)36-27-23-34(24-28-36)14-8-6-2/h9-10,17-28H,5-8,11-16,29-30H2,1-4H3/q+1