ethyl 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]ethanoate

Systemtic Name: ethyl 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]ethanoate Openeye Name: ethyl 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]acetate CAS Name: 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]acetate Traditional Name: 2-[4-cyano-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]acetic acid ethyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCC(CC1)(C#N)C2=C3C(=C(C=C2)OC)OCCO3

Isomeric SMILES

CCOC(=O)CC1CCC(CC1)(C#N)C2=C3C(=C(C=C2)OC)OCCO3

InChI

InChI=1S/C20H25NO5/c1-3-24-17(22)12-14-6-8-20(13-21,9-7-14)15-4-5-16(23-2)19-18(15)25-10-11-26-19/h4-5,14H,3,6-12H2,1-2H3