dimethyl 2-(2-cyanoethyl)-3-methyl-hexanedioate

Systemtic Name: dimethyl 2-(2-cyanoethyl)-3-methyl-hexanedioate Openeye Name: dimethyl 2-(2-cyanoethyl)-3-methyl-hexanedioate CAS Name: 2-(2-cyanoethyl)-3-methylhexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-cyanoethyl)-3-methylhexanedioate Traditional Name: 2-(2-cyanoethyl)-3-methyl-adipic acid dimethyl ester Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO4/c1-9(6-7-11(14)16-2)10(5-4-8-13)12(15)17-3/h9-10H,4-7H2,1-3H3