4-[4,7-dihexyl-9-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4,7-dihexyl-9-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4,7-dihexyl-9-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4,7-dihexyl-9-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4,7-dihexyl-9-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4,7-dihexyl-9-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,10-dihydro-1,10-phenanthrolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C36H40N2O2 MolecularWeight: 532.715

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C2C=CC(=O)C=C2)NC3=C1C=CC4=C3NC(=C5C=CC(=O)C=C5)C=C4CCCCCC

Isomeric SMILES

CCCCCCC1=CC(=C2C=CC(=O)C=C2)NC3=C1C=CC4=C3NC(=C5C=CC(=O)C=C5)C=C4CCCCCC

InChI

InChI=1S/C36H40N2O2/c1-3-5-7-9-11-27-23-33(25-13-17-29(39)18-14-25)37-35-31(27)21-22-32-28(12-10-8-6-4-2)24-34(38-36(32)35)26-15-19-30(40)20-16-26/h13-24,37-38H,3-12H2,1-2H3