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

Systemtic Name: diethyl 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioate; N-methylmethanamine Openeye Name: diethyl 2-[2-cyano-1-ethyl-2-(3-methoxyphenyl)butylidene]propanedioate; N-methylmethanamine CAS Name: 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioic acid diethyl ester; N-methylmethanamine IUPAC Name: diethyl 2-[4-cyano-4-(3-methoxyphenyl)hexan-3-ylidene]propanedioate; N-methylmethanamine Traditional Name: 2-[2-cyano-1-ethyl-2-(3-methoxyphenyl)butylidene]malonic acid diethyl ester; dimethylamine Formula: C23H34N2O5 MolecularWeight: 418.52646

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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.CNC

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO5.C2H7N/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;1-3-2/h10-13H,6-9H2,1-5H3;3H,1-2H3