2-(1-cyano-3-methyl-butyl)pentanedioic acid

Systemtic Name: 2-(1-cyano-3-methyl-butyl)pentanedioic acid Openeye Name: 2-(1-cyano-3-methyl-butyl)pentanedioic acid CAS Name: 2-(1-cyano-3-methylbutyl)pentanedioic acid IUPAC Name: 2-(1-cyano-3-methylbutyl)pentanedioic acid Traditional Name: 2-(1-cyano-3-methyl-butyl)glutaric acid Formula: C11H17NO4 MolecularWeight: 227.25698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NO4/c1-7(2)5-8(6-12)9(11(15)16)3-4-10(13)14/h7-9H,3-5H2,1-2H3,(H,13,14)(H,15,16)