(3R)-3-[(1S,4R)-4-methyl-1-(2-methylpropanoyl)-3-oxidanylidene-cyclohexyl]butanoate

Systemtic Name: (3R)-3-[(1S,4R)-4-methyl-1-(2-methylpropanoyl)-3-oxidanylidene-cyclohexyl]butanoate Openeye Name: (3R)-3-[(1S,4R)-4-methyl-1-(2-methylpropanoyl)-3-oxo-cyclohexyl]butanoate CAS Name: (3R)-3-[(1S,4R)-4-methyl-1-(2-methyl-1-oxopropyl)-3-oxocyclohexyl]butanoate IUPAC Name: (3R)-3-[(1S,4R)-4-methyl-1-(2-methylpropanoyl)-3-oxocyclohexyl]butanoate Traditional Name: (3R)-3-[(1S,4R)-1-isobutyryl-3-keto-4-methyl-cyclohexyl]butyrate Formula: C15H23O4- MolecularWeight: 267.34072

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1=O)(C(C)CC(=O)[O-])C(=O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C15H24O4/c1-9(2)14(19)15(11(4)7-13(17)18)6-5-10(3)12(16)8-15/h9-11H,5-8H2,1-4H3,(H,17,18)/p-1/t10-,11-,15+/m1/s1