(E)-1-methoxy-3-oxidanylidene-3-pyridin-4-yl-2-(tributylphosphaniumylmethyl)prop-1-en-1-olate

Systemtic Name: (E)-1-methoxy-3-oxidanylidene-3-pyridin-4-yl-2-(tributylphosphaniumylmethyl)prop-1-en-1-olate Openeye Name: (E)-1-methoxy-3-oxo-3-(4-pyridyl)-2-(tributylphosphaniumylmethyl)prop-1-en-1-olate CAS Name: (E)-1-methoxy-3-oxo-3-pyridin-4-yl-2-(tributylphosphiniumylmethyl)-1-propen-1-olate IUPAC Name: (E)-1-methoxy-3-oxo-3-pyridin-4-yl-2-(tributylphosphaniumylmethyl)prop-1-en-1-olate Traditional Name: (E)-3-keto-1-methoxy-3-(4-pyridyl)-2-(tributylphosphiniumylmethyl)prop-1-en-1-olate Formula: C22H36NO3P MolecularWeight: 393.499901

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CC(=C([O-])OC)C(=O)C1=CC=NC=C1

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)C/C(=C(\[O-])/OC)/C(=O)C1=CC=NC=C1

InChI

InChI=1S/C22H36NO3P/c1-5-8-15-27(16-9-6-2,17-10-7-3)18-20(22(25)26-4)21(24)19-11-13-23-14-12-19/h11-14H,5-10,15-18H2,1-4H3