2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenyl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenylcyclohepta-2,4,6-trien-1-one Traditional Name: 2,4-bis[bis(4-tert-butylphenyl)methyl]-5-methoxy-6-phenyl-cyclohepta-2,4,6-trien-1-one Formula: C56H64O2 MolecularWeight: 769.10616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)C3=CC(=C(C(=CC3=O)C4=CC=CC=C4)OC)C(C5=CC=C(C=C5)C(C)(C)C)C6=CC=C(C=C6)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)C3=CC(=C(C(=CC3=O)C4=CC=CC=C4)OC)C(C5=CC=C(C=C5)C(C)(C)C)C6=CC=C(C=C6)C(C)(C)C

InChI

InChI=1S/C56H64O2/c1-53(2,3)42-27-19-38(20-28-42)50(39-21-29-43(30-22-39)54(4,5)6)47-35-48(52(58-13)46(36-49(47)57)37-17-15-14-16-18-37)51(40-23-31-44(32-24-40)55(7,8)9)41-25-33-45(34-26-41)56(10,11)12/h14-36,50-51H,1-13H3