(3R,5R)-3-cyano-5-methyl-heptanoic acid

Systemtic Name: (3R,5R)-3-cyano-5-methyl-heptanoic acid Openeye Name: (3R,5R)-3-cyano-5-methyl-heptanoic acid CAS Name: (3R,5R)-3-cyano-5-methylheptanoic acid IUPAC Name: (3R,5R)-3-cyano-5-methylheptanoic acid Traditional Name: (3R,5R)-3-cyano-5-methyl-enanthic acid Formula: C9H15NO2 MolecularWeight: 169.2209

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)C[C@H](CC(=O)O)C#N

InChI

InChI=1S/C9H15NO2/c1-3-7(2)4-8(6-10)5-9(11)12/h7-8H,3-5H2,1-2H3,(H,11,12)/t7-,8-/m1/s1