1-[(3-fluoranyl-4-methoxy-phenyl)-(2-methylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-fluoranyl-4-methoxy-phenyl)-(2-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-fluoro-4-methoxy-phenyl)-(o-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-fluoro-4-methoxyphenyl)-(2-methylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-fluoro-4-methoxyphenyl)-(2-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-fluoro-4-methoxy-phenyl)-(o-tolyl)methyl]proline Formula: C20H22FNO3 MolecularWeight: 343.391983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=C(C=C2)OC)F)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=C(C=C2)OC)F)N3CCCC3C(=O)O

InChI

InChI=1S/C20H22FNO3/c1-13-6-3-4-7-15(13)19(22-11-5-8-17(22)20(23)24)14-9-10-18(25-2)16(21)12-14/h3-4,6-7,9-10,12,17,19H,5,8,11H2,1-2H3,(H,23,24)