[(2R,3S,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-phenyl-3-(phenylcarbonyl)cyclohexylidene]-phenyl-methanolate

Systemtic Name: [(2R,3S,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-phenyl-3-(phenylcarbonyl)cyclohexylidene]-phenyl-methanolate Openeye Name: [(2R,3S,4S)-3-benzoyl-4-hydroxy-4-methyl-6-oxo-2-phenyl-cyclohexylidene]-phenyl-methanolate CAS Name: [(2R,3S,4S)-3-benzoyl-4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexylidene]-phenylmethanolate IUPAC Name: [(2R,3S,4S)-3-benzoyl-4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexylidene]-phenylmethanolate Traditional Name: [(2R,3S,4S)-3-benzoyl-4-hydroxy-6-keto-4-methyl-2-phenyl-cyclohexylidene]-phenyl-methanolate Formula: C27H23O4- MolecularWeight: 411.46912

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(C2=CC=CC=C2)[O-])C(C1C(=O)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

C[C@@]1(CC(=O)C(=C(C2=CC=CC=C2)[O-])[C@H]([C@@H]1C(=O)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C27H24O4/c1-27(31)17-21(28)23(25(29)19-13-7-3-8-14-19)22(18-11-5-2-6-12-18)24(27)26(30)20-15-9-4-10-16-20/h2-16,22,24,29,31H,17H2,1H3/p-1/t22-,24-,27+/m1/s1