(Z)-4-oxidanylidene-4-propan-2-yloxy-1-triphenylphosphaniumyl-but-1-en-2-olate

Systemtic Name: (Z)-4-oxidanylidene-4-propan-2-yloxy-1-triphenylphosphaniumyl-but-1-en-2-olate Openeye Name: (Z)-4-isopropoxy-4-oxo-1-triphenylphosphaniumyl-but-1-en-2-olate CAS Name: (Z)-4-oxo-4-propan-2-yloxy-1-triphenylphosphiniumyl-1-buten-2-olate IUPAC Name: (Z)-4-oxo-4-propan-2-yloxy-1-triphenylphosphaniumylbut-1-en-2-olate Traditional Name: (Z)-4-isopropoxy-4-keto-1-triphenylphosphiniumyl-but-1-en-2-olate Formula: C25H25O3P MolecularWeight: 404.437961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(=C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC(C)OC(=O)C/C(=C/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/[O-]

InChI

InChI=1S/C25H25O3P/c1-20(2)28-25(27)18-21(26)19-29(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17,19-20H,18H2,1-2H3/b21-19-