(2R,4S)-1-(3,4-dichlorophenyl)carbonyl-4-methoxy-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-(3,4-dichlorophenyl)carbonyl-4-methoxy-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-(3,4-dichlorobenzoyl)-4-methoxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-[(3,4-dichlorophenyl)-oxomethyl]-4-methoxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-(3,4-dichlorobenzoyl)-4-methoxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-(3,4-dichlorobenzoyl)-4-methoxy-pyrrolidine-2-carboxylate Formula: C13H12Cl2NO4- MolecularWeight: 317.14468

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)[O-]

Isomeric SMILES

CO[C@H]1C[C@@H](N(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C13H13Cl2NO4/c1-20-8-5-11(13(18)19)16(6-8)12(17)7-2-3-9(14)10(15)4-7/h2-4,8,11H,5-6H2,1H3,(H,18,19)/p-1/t8-,11+/m0/s1