dimethyl 2-cyano-3-(2-methoxy-2-oxidanylidene-ethyl)-3-pentyl-pentanedioate

Systemtic Name: dimethyl 2-cyano-3-(2-methoxy-2-oxidanylidene-ethyl)-3-pentyl-pentanedioate Openeye Name: dimethyl 2-cyano-3-(2-methoxy-2-oxo-ethyl)-3-pentyl-pentanedioate CAS Name: 2-cyano-3-(2-methoxy-2-oxoethyl)-3-pentylpentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-cyano-3-(2-methoxy-2-oxoethyl)-3-pentylpentanedioate Traditional Name: 3-amyl-2-cyano-3-(2-keto-2-methoxy-ethyl)glutaric acid dimethyl ester Formula: C16H25NO6 MolecularWeight: 327.3728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO6/c1-5-6-7-8-16(9-13(18)21-2,10-14(19)22-3)12(11-17)15(20)23-4/h12H,5-10H2,1-4H3