2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-adamantylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-adamantylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-adamantylidene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-2-adamantylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2-adamantylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[4-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-adamantylidene]cyclohexa-2,5-dien-1-one Formula: C38H52O2 MolecularWeight: 540.81828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C3CC4CC(C3)C(=C5C=C(C(=O)C(=C5)C(C)(C)C)C(C)(C)C)C2C4)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C3CC4CC(C3)C(=C5C=C(C(=O)C(=C5)C(C)(C)C)C(C)(C)C)C2C4)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C38H52O2/c1-35(2,3)27-17-24(18-28(33(27)39)36(4,5)6)31-22-13-21-14-23(16-22)32(26(31)15-21)25-19-29(37(7,8)9)34(40)30(20-25)38(10,11)12/h17-23,26H,13-16H2,1-12H3