4-cyano-4-methyl-3-oxidanyl-pentanoate

Systemtic Name: 4-cyano-4-methyl-3-oxidanyl-pentanoate Openeye Name: 4-cyano-3-hydroxy-4-methyl-pentanoate CAS Name: 4-cyano-3-hydroxy-4-methylpentanoate IUPAC Name: 4-cyano-3-hydroxy-4-methylpentanoate Traditional Name: 4-cyano-3-hydroxy-4-methyl-valerate Formula: C7H10NO3- MolecularWeight: 156.1592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11NO3/c1-7(2,4-8)5(9)3-6(10)11/h5,9H,3H2,1-2H3,(H,10,11)/p-1