6-(4-chlorophenyl)-2,4-bis(diphenylmethyl)-5-methoxy-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 6-(4-chlorophenyl)-2,4-bis(diphenylmethyl)-5-methoxy-cyclohepta-2,4,6-trien-1-one Openeye Name: 2,4-dibenzhydryl-6-(4-chlorophenyl)-5-methoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 6-(4-chlorophenyl)-2,4-bis(diphenylmethyl)-5-methoxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 2,4-dibenzhydryl-6-(4-chlorophenyl)-5-methoxycyclohepta-2,4,6-trien-1-one Traditional Name: 2,4-dibenzhydryl-6-(4-chlorophenyl)-5-methoxy-cyclohepta-2,4,6-trien-1-one Formula: C40H31ClO2 MolecularWeight: 579.12594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=O)C=C1C2=CC=C(C=C2)Cl)C(C3=CC=CC=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=C(C=C(C(=O)C=C1C2=CC=C(C=C2)Cl)C(C3=CC=CC=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C40H31ClO2/c1-43-40-34(28-22-24-33(41)25-23-28)27-37(42)35(38(29-14-6-2-7-15-29)30-16-8-3-9-17-30)26-36(40)39(31-18-10-4-11-19-31)32-20-12-5-13-21-32/h2-27,38-39H,1H3