methyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxidanylidene-hexyl]benzoate

Systemtic Name: methyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxidanylidene-hexyl]benzoate Openeye Name: methyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxo-hexyl]benzoate CAS Name: 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxohexyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxohexyl]benzoate Traditional Name: 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-keto-hexyl]benzoic acid methyl ester Formula: C20H27NO6 MolecularWeight: 377.43148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(CCCC1=CC=C(C=C1)C(=O)OC)C(OC)OC

Isomeric SMILES

CCOC(=O)C(C#N)C(CCCC1=CC=C(C=C1)C(=O)OC)C(OC)OC

InChI

InChI=1S/C20H27NO6/c1-5-27-19(23)17(13-21)16(20(25-3)26-4)8-6-7-14-9-11-15(12-10-14)18(22)24-2/h9-12,16-17,20H,5-8H2,1-4H3