[(3S,4R)-4-methyl-5-oxidanylidene-heptan-3-yl] propanoate

Systemtic Name: [(3S,4R)-4-methyl-5-oxidanylidene-heptan-3-yl] propanoate Openeye Name: [(1S,2R)-1-ethyl-2-methyl-3-oxo-pentyl] propanoate CAS Name: propanoic acid [(3S,4R)-4-methyl-5-oxoheptan-3-yl] ester IUPAC Name: [(3S,4R)-4-methyl-5-oxoheptan-3-yl] propanoate Traditional Name: propionic acid [(1S,2R)-1-ethyl-3-keto-2-methyl-pentyl] ester Formula: C11H20O3 MolecularWeight: 200.2747

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C(=O)CC)OC(=O)CC

Isomeric SMILES

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

InChI

InChI=1S/C11H20O3/c1-5-9(12)8(4)10(6-2)14-11(13)7-3/h8,10H,5-7H2,1-4H3/t8-,10-/m0/s1