(5S,6S)-5-(4-chlorophenyl)-3-methyl-2,6-bis(phenylcarbonyl)cyclohex-2-en-1-one

Systemtic Name: (5S,6S)-5-(4-chlorophenyl)-3-methyl-2,6-bis(phenylcarbonyl)cyclohex-2-en-1-one Openeye Name: (5S,6S)-2,6-dibenzoyl-5-(4-chlorophenyl)-3-methyl-cyclohex-2-en-1-one CAS Name: (5S,6S)-2,6-dibenzoyl-5-(4-chlorophenyl)-3-methyl-1-cyclohex-2-enone IUPAC Name: (5S,6S)-2,6-dibenzoyl-5-(4-chlorophenyl)-3-methylcyclohex-2-en-1-one Traditional Name: (5S,6S)-2,6-dibenzoyl-5-(4-chlorophenyl)-3-methyl-cyclohex-2-en-1-one Formula: C27H21ClO3 MolecularWeight: 428.90684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(C(C1)C2=CC=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)[C@@H]([C@H](C1)C2=CC=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H21ClO3/c1-17-16-22(18-12-14-21(28)15-13-18)24(26(30)20-10-6-3-7-11-20)27(31)23(17)25(29)19-8-4-2-5-9-19/h2-15,22,24H,16H2,1H3/t22-,24+/m1/s1