copper (1Z,4E)-3-oxidanylidene-1,5-diphenyl-penta-1,4-dien-1-olate

Systemtic Name: copper (1Z,4E)-3-oxidanylidene-1,5-diphenyl-penta-1,4-dien-1-olate Openeye Name: copper (1Z,4E)-3-oxo-1,5-diphenyl-penta-1,4-dien-1-olate CAS Name: copper (1Z,4E)-3-oxo-1,5-diphenyl-1-penta-1,4-dienolate IUPAC Name: copper (1Z,4E)-3-oxo-1,5-diphenylpenta-1,4-dien-1-olate Traditional Name: cupric (1Z,4E)-3-keto-1,5-diphenyl-penta-1,4-dien-1-olate Formula: C34H26CuO4 MolecularWeight: 562.11384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)C=C(C2=CC=CC=C2)[O-].C1=CC=C(C=C1)C=CC(=O)C=C(C2=CC=CC=C2)[O-].[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)/C=C(\[O-])/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C(\[O-])/C2=CC=CC=C2.[Cu+2]

InChI

InChI=1S/2C17H14O2.Cu/c2*18-16(12-11-14-7-3-1-4-8-14)13-17(19)15-9-5-2-6-10-15;/h2*1-13,19H;/q;;+2/p-2/b2*12-11+,17-13-;