(2R,4S)-1-(3H-benzimidazol-5-ylcarbonyl)-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-1-(3H-benzimidazol-5-ylcarbonyl)-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-1-[3H-benzimidazol-5-yl(oxo)methyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-1-(3H-benzimidazole-5-carbonyl)-4-methoxy-proline Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC3=C(C=C2)N=CN3)C(=O)O

Isomeric SMILES

CO[C@H]1C[C@@H](N(C1)C(=O)C2=CC3=C(C=C2)N=CN3)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-21-9-5-12(14(19)20)17(6-9)13(18)8-2-3-10-11(4-8)16-7-15-10/h2-4,7,9,12H,5-6H2,1H3,(H,15,16)(H,19,20)/t9-,12+/m0/s1