4-heptan-2-ylpyrrolidine-2-carboxylic acid

Systemtic Name: 4-heptan-2-ylpyrrolidine-2-carboxylic acid Openeye Name: 4-(1-methylhexyl)pyrrolidine-2-carboxylic acid CAS Name: 4-heptan-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-heptan-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(1-methylhexyl)proline Formula: C12H23NO2 MolecularWeight: 213.31652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CC(NC1)C(=O)O

Isomeric SMILES

CCCCCC(C)C1CC(NC1)C(=O)O

InChI

InChI=1S/C12H23NO2/c1-3-4-5-6-9(2)10-7-11(12(14)15)13-8-10/h9-11,13H,3-8H2,1-2H3,(H,14,15)