[(2S,4R,5S)-4-methyl-5-oxidanyl-3-oxidanylidene-5-phenyl-pentan-2-yl] benzoate

Systemtic Name: [(2S,4R,5S)-4-methyl-5-oxidanyl-3-oxidanylidene-5-phenyl-pentan-2-yl] benzoate Openeye Name: [(1S,3R,4S)-4-hydroxy-1,3-dimethyl-2-oxo-4-phenyl-butyl] benzoate CAS Name: benzoic acid [(2S,4R,5S)-5-hydroxy-4-methyl-3-oxo-5-phenylpentan-2-yl] ester IUPAC Name: [(2S,4R,5S)-5-hydroxy-4-methyl-3-oxo-5-phenylpentan-2-yl] benzoate Traditional Name: benzoic acid [(1S,3R,4S)-4-hydroxy-2-keto-1,3-dimethyl-4-phenyl-butyl] ester Formula: C19H20O4 MolecularWeight: 312.3597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)C(=O)C(C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H]([C@@H](C1=CC=CC=C1)O)C(=O)[C@H](C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20O4/c1-13(18(21)15-9-5-3-6-10-15)17(20)14(2)23-19(22)16-11-7-4-8-12-16/h3-14,18,21H,1-2H3/t13-,14-,18-/m0/s1