10-[2,3-bis(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]anthracen-9-one

Systemtic Name: 10-[2,3-bis(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]anthracen-9-one Openeye Name: 10-[2,3-bis(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]anthracen-9-one CAS Name: 10-[2,3-bis(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)cyclopropylidene]-9-anthracenone IUPAC Name: 10-[2,3-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclopropylidene]anthracen-9-one Traditional Name: 10-[2,3-bis(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)cyclopropylidene]anthracen-9-one Formula: C45H48O3 MolecularWeight: 636.86082

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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=C4C5=CC=CC=C5C(=O)C6=CC=CC=C64)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=C4C5=CC=CC=C5C(=O)C6=CC=CC=C64)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C45H48O3/c1-42(2,3)31-21-25(22-32(40(31)47)43(4,5)6)35-36(26-23-33(44(7,8)9)41(48)34(24-26)45(10,11)12)38(35)37-27-17-13-15-19-29(27)39(46)30-20-16-14-18-28(30)37/h13-24H,1-12H3