[(1S,2R)-2-methyl-5-oxidanylidene-1-[(2R)-4-oxidanylidenebutan-2-yl]cyclopentyl]carbonyl benzoate

Systemtic Name: [(1S,2R)-2-methyl-5-oxidanylidene-1-[(2R)-4-oxidanylidenebutan-2-yl]cyclopentyl]carbonyl benzoate Openeye Name: [(1S,2R)-2-methyl-1-[(1R)-1-methyl-3-oxo-propyl]-5-oxo-cyclopentanecarbonyl] benzoate CAS Name: benzoic acid [[(1S,2R)-2-methyl-5-oxo-1-[(2R)-4-oxobutan-2-yl]cyclopentyl]-oxomethyl] ester IUPAC Name: [(1S,2R)-2-methyl-5-oxo-1-[(2R)-4-oxobutan-2-yl]cyclopentanecarbonyl] benzoate Traditional Name: benzoic acid [(1S,5R)-2-keto-1-[(1R)-3-keto-1-methyl-propyl]-5-methyl-cyclopentanecarbonyl] ester Formula: C18H20O5 MolecularWeight: 316.3484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C1(C(C)CC=O)C(=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H20O5/c1-12-8-9-15(20)18(12,13(2)10-11-19)17(22)23-16(21)14-6-4-3-5-7-14/h3-7,11-13H,8-10H2,1-2H3/t12-,13-,18+/m1/s1