[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl] 3-oxidanylidenebutanoate

Systemtic Name: [(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl] 3-oxidanylidenebutanoate Openeye Name: [(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl] ester IUPAC Name: [(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [(1R,2R)-2-p-anisyloxycyclohexyl] ester Formula: C18H24O5 MolecularWeight: 320.38016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OC1CCCCC1OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)CC(=O)O[C@@H]1CCCC[C@H]1OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H24O5/c1-13(19)11-18(20)23-17-6-4-3-5-16(17)22-12-14-7-9-15(21-2)10-8-14/h7-10,16-17H,3-6,11-12H2,1-2H3/t16-,17-/m1/s1