5-oxidanylidene-1-[4-(3-phenylpropyl)phenoxy]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-oxidanylidene-1-[4-(3-phenylpropyl)phenoxy]pyrrolidine-2-carboxylic acid Openeye Name: 5-oxo-1-[4-(3-phenylpropyl)phenoxy]pyrrolidine-2-carboxylic acid CAS Name: 5-oxo-1-[4-(3-phenylpropyl)phenoxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-oxo-1-[4-(3-phenylpropyl)phenoxy]pyrrolidine-2-carboxylic acid Traditional Name: 5-keto-1-[4-(3-phenylpropyl)phenoxy]proline Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)O)OC2=CC=C(C=C2)CCCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C1C(=O)O)OC2=CC=C(C=C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C20H21NO4/c22-19-14-13-18(20(23)24)21(19)25-17-11-9-16(10-12-17)8-4-7-15-5-2-1-3-6-15/h1-3,5-6,9-12,18H,4,7-8,13-14H2,(H,23,24)