1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,5-dimethylphenyl)-(2-fluorophenyl)methyl]proline Formula: C20H22FNO2 MolecularWeight: 327.392583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=CC=C2F)N3CCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=CC=C2F)N3CCCC3C(=O)O)C

InChI

InChI=1S/C20H22FNO2/c1-13-10-14(2)12-15(11-13)19(16-6-3-4-7-17(16)21)22-9-5-8-18(22)20(23)24/h3-4,6-7,10-12,18-19H,5,8-9H2,1-2H3,(H,23,24)