[1-(2-ethoxy-2-oxidanylidene-ethyl)-4,4-dimethyl-5,5-diphenyl-pyrazol-3-yl]-triphenyl-phosphanium

Systemtic Name: [1-(2-ethoxy-2-oxidanylidene-ethyl)-4,4-dimethyl-5,5-diphenyl-pyrazol-3-yl]-triphenyl-phosphanium Openeye Name: [1-(2-ethoxy-2-oxo-ethyl)-4,4-dimethyl-5,5-diphenyl-pyrazol-3-yl]-triphenyl-phosphonium CAS Name: [1-(2-ethoxy-2-oxoethyl)-4,4-dimethyl-5,5-diphenyl-3-pyrazolyl]-triphenylphosphonium IUPAC Name: [1-(2-ethoxy-2-oxoethyl)-4,4-dimethyl-5,5-diphenylpyrazol-3-yl]-triphenylphosphanium Traditional Name: [1-(2-ethoxy-2-keto-ethyl)-4,4-dimethyl-5,5-diphenyl-2-pyrazolin-3-yl]-triphenyl-phosphonium Formula: C39H38N2O2P+ MolecularWeight: 597.704981

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(C(C(=N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C)C)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)CN1C(C(C(=N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C)C)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H38N2O2P/c1-4-43-36(42)30-41-39(31-20-10-5-11-21-31,32-22-12-6-13-23-32)38(2,3)37(40-41)44(33-24-14-7-15-25-33,34-26-16-8-17-27-34)35-28-18-9-19-29-35/h5-29H,4,30H2,1-3H3/q+1