ethyl 3-[(1S,2S)-2-(2-ethoxy-2-methoxy-ethyl)-3-oxidanylidene-cycloheptyl]propanoate

Systemtic Name: ethyl 3-[(1S,2S)-2-(2-ethoxy-2-methoxy-ethyl)-3-oxidanylidene-cycloheptyl]propanoate Openeye Name: ethyl 3-[(1S,2S)-2-(2-ethoxy-2-methoxy-ethyl)-3-oxo-cycloheptyl]propanoate CAS Name: 3-[(1S,2S)-2-(2-ethoxy-2-methoxyethyl)-3-oxocycloheptyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(1S,2S)-2-(2-ethoxy-2-methoxyethyl)-3-oxocycloheptyl]propanoate Traditional Name: 3-[(1S,2S)-2-(2-ethoxy-2-methoxy-ethyl)-3-keto-cycloheptyl]propionic acid ethyl ester Formula: C17H30O5 MolecularWeight: 314.4171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1C(CCCCC1=O)CCC(=O)OCC)OC

Isomeric SMILES

CCOC(C[C@H]1[C@@H](CCCCC1=O)CCC(=O)OCC)OC

InChI

InChI=1S/C17H30O5/c1-4-21-16(19)11-10-13-8-6-7-9-15(18)14(13)12-17(20-3)22-5-2/h13-14,17H,4-12H2,1-3H3/t13-,14-,17?/m0/s1