methyl (2S)-3-(2-ethenyl-4,5-dimethoxy-phenyl)-2-[(1R)-2-oxidanylidenecyclohexyl]propanoate

Systemtic Name: methyl (2S)-3-(2-ethenyl-4,5-dimethoxy-phenyl)-2-[(1R)-2-oxidanylidenecyclohexyl]propanoate Openeye Name: methyl (2S)-3-(4,5-dimethoxy-2-vinyl-phenyl)-2-[(1R)-2-oxocyclohexyl]propanoate CAS Name: (2S)-3-(2-ethenyl-4,5-dimethoxyphenyl)-2-[(1R)-2-oxocyclohexyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(2-ethenyl-4,5-dimethoxyphenyl)-2-[(1R)-2-oxocyclohexyl]propanoate Traditional Name: (2S)-3-(4,5-dimethoxy-2-vinyl-phenyl)-2-[(1R)-2-ketocyclohexyl]propionic acid methyl ester Formula: C20H26O5 MolecularWeight: 346.41744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(C2CCCCC2=O)C(=O)OC)C=C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C[C@@H]([C@H]2CCCCC2=O)C(=O)OC)C=C)OC

InChI

InChI=1S/C20H26O5/c1-5-13-11-18(23-2)19(24-3)12-14(13)10-16(20(22)25-4)15-8-6-7-9-17(15)21/h5,11-12,15-16H,1,6-10H2,2-4H3/t15-,16+/m1/s1