4-(1-cyanohexan-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(1-cyanohexan-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 4-[1-(cyanomethyl)pentyl]pyrrolidine-2-carboxylic acid CAS Name: 4-(1-cyanohexan-2-yl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(1-cyanohexan-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 4-[1-(cyanomethyl)pentyl]proline Formula: C12H20N2O2 MolecularWeight: 224.2994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC#N)C1CC(NC1)C(=O)O

Isomeric SMILES

CCCCC(CC#N)C1CC(NC1)C(=O)O

InChI

InChI=1S/C12H20N2O2/c1-2-3-4-9(5-6-13)10-7-11(12(15)16)14-8-10/h9-11,14H,2-5,7-8H2,1H3,(H,15,16)