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

Systemtic Name: methyl (3R,4S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)carbonyl-4-(4-fluorophenyl)pyrrolidine-3-carboxylate Openeye Name: methyl (3R,4S)-1-(1-ethyl-3-methyl-pyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate CAS Name: (3R,4S)-1-[(1-ethyl-3-methyl-4-pyrazolyl)-oxomethyl]-4-(4-fluorophenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-1-(1-ethyl-3-methylpyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate Traditional Name: (3R,4S)-1-(1-ethyl-3-methyl-pyrazole-4-carbonyl)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C19H22FN3O3 MolecularWeight: 359.394683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN3O3/c1-4-23-11-15(12(2)21-23)18(24)22-9-16(17(10-22)19(25)26-3)13-5-7-14(20)8-6-13/h5-8,11,16-17H,4,9-10H2,1-3H3/t16-,17+/m1/s1