methyl (3R,4S)-1-(3H-benzimidazol-5-ylcarbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl (3R,4S)-1-(3H-benzimidazol-5-ylcarbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate Openeye Name: methyl (3R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate CAS Name: (3R,4S)-1-[3H-benzimidazol-5-yl(oxo)methyl]-4-(4-fluorophenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate Traditional Name: (3R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C20H18FN3O3 MolecularWeight: 367.373623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CC1C2=CC=C(C=C2)F)C(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

COC(=O)[C@H]1CN(C[C@@H]1C2=CC=C(C=C2)F)C(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C20H18FN3O3/c1-27-20(26)16-10-24(9-15(16)12-2-5-14(21)6-3-12)19(25)13-4-7-17-18(8-13)23-11-22-17/h2-8,11,15-16H,9-10H2,1H3,(H,22,23)/t15-,16+/m1/s1