(2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylic acid; propan-2-amine

Systemtic Name: (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylic acid; propan-2-amine Openeye Name: (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxo-pyrrolidine-2-carboxylic acid; propan-2-amine CAS Name: (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid; 2-propanamine IUPAC Name: (2S)-1-[(3,4-dichlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid; propan-2-amine Traditional Name: (2S)-1-(3,4-dichlorobenzyl)-5-keto-proline; isopropylamine Formula: C15H20Cl2N2O3 MolecularWeight: 347.2369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N.C1CC(=O)N(C1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)N.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H11Cl2NO3.C3H9N/c13-8-2-1-7(5-9(8)14)6-15-10(12(17)18)3-4-11(15)16;1-3(2)4/h1-2,5,10H,3-4,6H2,(H,17,18);3H,4H2,1-2H3/t10-;/m0./s1