diethyl 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioate

Systemtic Name: diethyl 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioate Openeye Name: diethyl 2-[2-cyano-1-ethyl-2-(3-methoxyphenyl)butylidene]propanedioate CAS Name: 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioate Traditional Name: 2-[2-cyano-1-ethyl-2-(3-methoxyphenyl)butylidene]malonic acid diethyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C(=O)OCC)C(=O)OCC)C(CC)(C#N)C1=CC(=CC=C1)OC

Isomeric SMILES

CCC(=C(C(=O)OCC)C(=O)OCC)C(CC)(C#N)C1=CC(=CC=C1)OC

InChI

InChI=1S/C21H27NO5/c1-6-17(18(19(23)26-8-3)20(24)27-9-4)21(7-2,14-22)15-11-10-12-16(13-15)25-5/h10-13H,6-9H2,1-5H3