O1-ethyl O4-methyl 2-cyano-3-(2,2-dimethylpropanoylamino)butanedioate

Systemtic Name: O1-ethyl O4-methyl 2-cyano-3-(2,2-dimethylpropanoylamino)butanedioate Openeye Name: O1-ethyl O4-methyl 2-cyano-3-(2,2-dimethylpropanoylamino)butanedioate CAS Name: 2-cyano-3-[(2,2-dimethyl-1-oxopropyl)amino]butanedioic acid O1-ethyl ester O4-methyl ester IUPAC Name: 1-O-ethyl 4-O-methyl 2-cyano-3-(2,2-dimethylpropanoylamino)butanedioate Traditional Name: 2-cyano-3-(pivaloylamino)succinic acid O1-ethyl ester O4-methyl ester Formula: C13H20N2O5 MolecularWeight: 284.3083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C(=O)OC)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C(C#N)C(C(=O)OC)NC(=O)C(C)(C)C

InChI

InChI=1S/C13H20N2O5/c1-6-20-10(16)8(7-14)9(11(17)19-5)15-12(18)13(2,3)4/h8-9H,6H2,1-5H3,(H,15,18)