copper; 2,6-ditert-butyl-4-[ethenoxy-(2-hydroxyphenyl)methyl]imino-cyclohexa-2,5-dien-1-one

Systemtic Name: copper; 2,6-ditert-butyl-4-[ethenoxy-(2-hydroxyphenyl)methyl]imino-cyclohexa-2,5-dien-1-one Openeye Name: copper; 2,6-ditert-butyl-4-[(2-hydroxyphenyl)-vinyloxy-methyl]imino-cyclohexa-2,5-dien-1-one CAS Name: copper; 2,6-ditert-butyl-4-[ethenoxy-(2-hydroxyphenyl)methyl]imino-1-cyclohexa-2,5-dienone IUPAC Name: copper; 2,6-ditert-butyl-4-[ethenoxy-(2-hydroxyphenyl)methyl]iminocyclohexa-2,5-dien-1-one Traditional Name: copper; 2,6-ditert-butyl-4-[(2-hydroxyphenyl)-vinyloxy-methyl]imino-cyclohexa-2,5-dien-1-one Formula: C46H58CuN2O6 MolecularWeight: 798.50852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(C2=CC=CC=C2O)OC=C)C=C(C1=O)C(C)(C)C.CC(C)(C)C1=CC(=NC(C2=CC=CC=C2O)OC=C)C=C(C1=O)C(C)(C)C.[Cu]

Isomeric SMILES

CC(C)(C)C1=CC(=NC(C2=CC=CC=C2O)OC=C)C=C(C1=O)C(C)(C)C.CC(C)(C)C1=CC(=NC(C2=CC=CC=C2O)OC=C)C=C(C1=O)C(C)(C)C.[Cu]

InChI

InChI=1S/2C23H29NO3.Cu/c2*1-8-27-21(16-11-9-10-12-19(16)25)24-15-13-17(22(2,3)4)20(26)18(14-15)23(5,6)7;/h2*8-14,21,25H,1H2,2-7H3;