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

Systemtic Name: 4-[2,3-bis(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2,3-bis(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[2,3-bis(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)cyclopropylidene]-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2,3-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclopropylidene]-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-[2,3-bis(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C45H60O3 MolecularWeight: 648.9561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C45H60O3/c1-40(2,3)28-19-25(20-29(37(28)46)41(4,5)6)34-35(26-21-30(42(7,8)9)38(47)31(22-26)43(10,11)12)36(34)27-23-32(44(13,14)15)39(48)33(24-27)45(16,17)18/h19-24H,1-18H3