(3R,4S)-3-(4-chlorophenyl)-4-(4-methoxyphenyl)carbonyl-3-oxidanyl-cyclohexan-1-one

Systemtic Name: (3R,4S)-3-(4-chlorophenyl)-4-(4-methoxyphenyl)carbonyl-3-oxidanyl-cyclohexan-1-one Openeye Name: (3R,4S)-3-(4-chlorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)cyclohexanone CAS Name: (3R,4S)-3-(4-chlorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)-oxomethyl]-1-cyclohexanone IUPAC Name: (3R,4S)-3-(4-chlorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)cyclohexan-1-one Traditional Name: (3R,4S)-3-(4-chlorophenyl)-3-hydroxy-4-p-anisoyl-cyclohexanone Formula: C20H19ClO4 MolecularWeight: 358.81546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCC(=O)CC2(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)[C@H]2CCC(=O)C[C@@]2(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H19ClO4/c1-25-17-9-2-13(3-10-17)19(23)18-11-8-16(22)12-20(18,24)14-4-6-15(21)7-5-14/h2-7,9-10,18,24H,8,11-12H2,1H3/t18-,20+/m1/s1