methyl 3-[3,6-bis(dicyanomethylidene)-4-(3-methoxy-2-methyl-3-oxidanylidene-propyl)cyclohexa-1,4-dien-1-yl]-2-methyl-propanoate

Systemtic Name: methyl 3-[3,6-bis(dicyanomethylidene)-4-(3-methoxy-2-methyl-3-oxidanylidene-propyl)cyclohexa-1,4-dien-1-yl]-2-methyl-propanoate Openeye Name: methyl 3-[3,6-bis(dicyanomethylene)-4-(3-methoxy-2-methyl-3-oxo-propyl)cyclohexa-1,4-dien-1-yl]-2-methyl-propanoate CAS Name: 3-[3,6-bis(dicyanomethylidene)-4-(3-methoxy-2-methyl-3-oxopropyl)-1-cyclohexa-1,4-dienyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-[3,6-bis(dicyanomethylidene)-4-(3-methoxy-2-methyl-3-oxopropyl)cyclohexa-1,4-dien-1-yl]-2-methylpropanoate Traditional Name: 3-[3,6-bis(dicyanomethylene)-4-(3-keto-3-methoxy-2-methyl-propyl)cyclohexa-1,4-dien-1-yl]-2-methyl-propionic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C#N)C#N)C(=CC1=C(C#N)C#N)CC(C)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(CC1=CC(=C(C#N)C#N)C(=CC1=C(C#N)C#N)CC(C)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H20N4O4/c1-13(21(27)29-3)5-15-7-20(18(11-25)12-26)16(6-14(2)22(28)30-4)8-19(15)17(9-23)10-24/h7-8,13-14H,5-6H2,1-4H3