3-bromanyl-7,9-bis(3,5-ditert-butylphenyl)cyclopenta[a]acenaphthylen-8-one

Systemtic Name: 3-bromanyl-7,9-bis(3,5-ditert-butylphenyl)cyclopenta[a]acenaphthylen-8-one Openeye Name: 3-bromo-7,9-bis(3,5-ditert-butylphenyl)cyclopenta[a]acenaphthylen-8-one CAS Name: 3-bromo-7,9-bis(3,5-ditert-butylphenyl)-8-cyclopenta[a]acenaphthylenone IUPAC Name: 3-bromo-7,9-bis(3,5-ditert-butylphenyl)cyclopenta[a]acenaphthylen-8-one Traditional Name: 3-bromo-7,9-bis(3,5-ditert-butylphenyl)cyclopent[a]acenaphthylen-8-one Formula: C43H47BrO MolecularWeight: 659.73668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=C3C4=C5C(=C(C=C4)Br)C=CC=C5C3=C(C2=O)C6=CC(=CC(=C6)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=C3C4=C5C(=C(C=C4)Br)C=CC=C5C3=C(C2=O)C6=CC(=CC(=C6)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C43H47BrO/c1-40(2,3)26-18-24(19-27(22-26)41(4,5)6)34-37-31-15-13-14-30-33(44)17-16-32(36(30)31)38(37)35(39(34)45)25-20-28(42(7,8)9)23-29(21-25)43(10,11)12/h13-23H,1-12H3