3,5-dimethylpyrazol-2-ide; 1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 3,5-dimethylpyrazol-2-ide; 1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-benzyloxycarbonylpyrrolidine-2-carboxylic acid; 3,5-dimethylpyrazol-2-ide CAS Name: 3,5-dimethylpyrazol-2-ide; 1-phenylmethoxycarbonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 3,5-dimethylpyrazol-2-ide; 1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid Traditional Name: 1-carbobenzoxyproline; 3,5-dimethylpyrazol-2-ide Formula: C18H22N3O4- MolecularWeight: 344.38498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N[N-]1)C.C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=N[N-]1)C.C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H15NO4.C5H7N2/c15-12(16)11-7-4-8-14(11)13(17)18-9-10-5-2-1-3-6-10;1-4-3-5(2)7-6-4/h1-3,5-6,11H,4,7-9H2,(H,15,16);3H,1-2H3/q;-1