3-cyano-5-methyl-4-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: 3-cyano-5-methyl-4-oxidanylidene-piperidine-1-carboxylate Openeye Name: 3-cyano-5-methyl-4-oxo-piperidine-1-carboxylate CAS Name: 3-cyano-5-methyl-4-oxo-1-piperidinecarboxylate IUPAC Name: 3-cyano-5-methyl-4-oxopiperidine-1-carboxylate Traditional Name: 3-cyano-4-keto-5-methyl-piperidine-1-carboxylate Formula: C8H9N2O3- MolecularWeight: 181.16866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1=O)C#N)C(=O)[O-]

Isomeric SMILES

CC1CN(CC(C1=O)C#N)C(=O)[O-]

InChI

InChI=1S/C8H10N2O3/c1-5-3-10(8(12)13)4-6(2-9)7(5)11/h5-6H,3-4H2,1H3,(H,12,13)/p-1