(3R,4S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)carbonyl-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid

Systemtic Name: (3R,4S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)carbonyl-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid Openeye Name: (3R,4S)-1-(1-ethyl-3-methyl-pyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid CAS Name: (3R,4S)-1-[(1-ethyl-3-methyl-4-pyrazolyl)-oxomethyl]-4-(4-fluorophenyl)-3-pyrrolidinecarboxylic acid IUPAC Name: (3R,4S)-1-(1-ethyl-3-methylpyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid Traditional Name: (3R,4S)-1-(1-ethyl-3-methyl-pyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C(=O)N2CC(C(C2)C(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C=C(C(=N1)C)C(=O)N2C[C@@H]([C@H](C2)C(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O3/c1-3-22-10-14(11(2)20-22)17(23)21-8-15(16(9-21)18(24)25)12-4-6-13(19)7-5-12/h4-7,10,15-16H,3,8-9H2,1-2H3,(H,24,25)/t15-,16+/m1/s1