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

Systemtic Name: 2-[2,3-bis(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]indene-1,3-dione Openeye Name: 2-[2,3-bis(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]indane-1,3-dione CAS Name: 2-[2,3-bis(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)cyclopropylidene]indene-1,3-dione IUPAC Name: 2-[2,3-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclopropylidene]indene-1,3-dione Traditional Name: 2-[2,3-bis(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]indane-1,3-quinone Formula: C40H44O4 MolecularWeight: 588.77496

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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(=O)C5=CC=CC=C5C4=O)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(=O)C5=CC=CC=C5C4=O)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C40H44O4/c1-37(2,3)25-17-21(18-26(35(25)43)38(4,5)6)29-30(31(29)32-33(41)23-15-13-14-16-24(23)34(32)42)22-19-27(39(7,8)9)36(44)28(20-22)40(10,11)12/h13-20H,1-12H3