propan-2-yl (1S,4R,6R)-4-methyl-4-oxidanyl-2-oxidanylidene-6-phenyl-cyclohexane-1-carboxylate

Systemtic Name: propan-2-yl (1S,4R,6R)-4-methyl-4-oxidanyl-2-oxidanylidene-6-phenyl-cyclohexane-1-carboxylate Openeye Name: isopropyl (1S,4R,6R)-4-hydroxy-4-methyl-2-oxo-6-phenyl-cyclohexanecarboxylate CAS Name: (1S,4R,6R)-4-hydroxy-4-methyl-2-oxo-6-phenyl-1-cyclohexanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (1S,4R,6R)-4-hydroxy-4-methyl-2-oxo-6-phenylcyclohexane-1-carboxylate Traditional Name: (1S,4R,6R)-4-hydroxy-2-keto-4-methyl-6-phenyl-cyclohexanecarboxylic acid isopropyl ester Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1C(CC(CC1=O)(C)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)[C@H]1[C@@H](C[C@@](CC1=O)(C)O)C2=CC=CC=C2

InChI

InChI=1S/C17H22O4/c1-11(2)21-16(19)15-13(12-7-5-4-6-8-12)9-17(3,20)10-14(15)18/h4-8,11,13,15,20H,9-10H2,1-3H3/t13-,15-,17+/m0/s1