5-oxidanylidene-3-pentyl-4-phenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-oxidanylidene-3-pentyl-4-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-oxo-3-pentyl-4-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 5-oxo-3-pentyl-4-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 5-oxo-3-pentyl-4-phenylpyrrolidine-2-carboxylic acid Traditional Name: 3-amyl-5-keto-4-phenyl-proline Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C(=O)NC1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1C(C(=O)NC1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H21NO3/c1-2-3-5-10-12-13(11-8-6-4-7-9-11)15(18)17-14(12)16(19)20/h4,6-9,12-14H,2-3,5,10H2,1H3,(H,17,18)(H,19,20)