methyl 2-cyano-3-cyclopropyl-3-methyl-pentanoate

Systemtic Name: methyl 2-cyano-3-cyclopropyl-3-methyl-pentanoate Openeye Name: methyl 2-cyano-3-cyclopropyl-3-methyl-pentanoate CAS Name: 2-cyano-3-cyclopropyl-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-cyclopropyl-3-methylpentanoate Traditional Name: 2-cyano-3-cyclopropyl-3-methyl-valeric acid methyl ester Formula: C11H17NO2 MolecularWeight: 195.25818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1CC1)C(C#N)C(=O)OC

Isomeric SMILES

CCC(C)(C1CC1)C(C#N)C(=O)OC

InChI

InChI=1S/C11H17NO2/c1-4-11(2,8-5-6-8)9(7-12)10(13)14-3/h8-9H,4-6H2,1-3H3