methyl 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylate

Systemtic Name: methyl 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylate Openeye Name: methyl 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylate CAS Name: 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxyphenyl]cyclohexene-1-carboxylate Traditional Name: 5-cyano-5-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylic acid methyl ester Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC=C(C2)C(=O)OC)C#N)OCC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC=C(C2)C(=O)OC)C#N)OCC3CC3

InChI

InChI=1S/C20H23NO4/c1-23-17-8-7-16(10-18(17)25-12-14-5-6-14)20(13-21)9-3-4-15(11-20)19(22)24-2/h4,7-8,10,14H,3,5-6,9,11-12H2,1-2H3