(6E)-6-(2-methoxy-2-oxidanylidene-ethylidene)-1-(2-methoxy-2-oxidanylidene-1-triphenylphosphaniumyl-ethyl)-4-(triphenylmethyl)cyclohexa-2,4-dien-1-olate

Systemtic Name: (6E)-6-(2-methoxy-2-oxidanylidene-ethylidene)-1-(2-methoxy-2-oxidanylidene-1-triphenylphosphaniumyl-ethyl)-4-(triphenylmethyl)cyclohexa-2,4-dien-1-olate Openeye Name: (6E)-6-(2-methoxy-2-oxo-ethylidene)-1-(2-methoxy-2-oxo-1-triphenylphosphaniumyl-ethyl)-4-trityl-cyclohexa-2,4-dien-1-olate CAS Name: (6E)-6-(2-methoxy-2-oxoethylidene)-1-(2-methoxy-2-oxo-1-triphenylphosphiniumylethyl)-4-(triphenylmethyl)-1-cyclohexa-2,4-dienolate IUPAC Name: (6E)-6-(2-methoxy-2-oxoethylidene)-1-(2-methoxy-2-oxo-1-triphenylphosphaniumylethyl)-4-tritylcyclohexa-2,4-dien-1-olate Traditional Name: (6E)-6-(2-keto-2-methoxy-ethylidene)-1-(2-keto-2-methoxy-1-triphenylphosphiniumyl-ethyl)-4-trityl-cyclohexa-2,4-dien-1-olate Formula: C49H41O5P MolecularWeight: 740.820601

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1C=C(C=CC1(C(C(=O)OC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[O-])C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

COC(=O)/C=C/1\C=C(C=CC1(C(C(=O)OC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[O-])C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C49H41O5P/c1-53-45(50)36-41-35-40(49(37-21-9-3-10-22-37,38-23-11-4-12-24-38)39-25-13-5-14-26-39)33-34-48(41,52)46(47(51)54-2)55(42-27-15-6-16-28-42,43-29-17-7-18-30-43)44-31-19-8-20-32-44/h3-36,46H,1-2H3/b41-36+