methyl (3R,4S)-4-(4-fluorophenyl)-1-(5-methyl-1-propyl-pyrazol-4-yl)carbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl (3R,4S)-4-(4-fluorophenyl)-1-(5-methyl-1-propyl-pyrazol-4-yl)carbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl (3R,4S)-4-(4-fluorophenyl)-1-(5-methyl-1-propyl-pyrazole-4-carbonyl)pyrrolidine-3-carboxylate CAS Name: (3R,4S)-4-(4-fluorophenyl)-1-[(5-methyl-1-propyl-4-pyrazolyl)-oxomethyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-4-(4-fluorophenyl)-1-(5-methyl-1-propylpyrazole-4-carbonyl)pyrrolidine-3-carboxylate Traditional Name: (3R,4S)-4-(4-fluorophenyl)-1-(5-methyl-1-propyl-pyrazole-4-carbonyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C20H24FN3O3 MolecularWeight: 373.421263

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C(=O)N2CC(C(C2)C(=O)OC)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCCN1C(=C(C=N1)C(=O)N2C[C@@H]([C@H](C2)C(=O)OC)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H24FN3O3/c1-4-9-24-13(2)16(10-22-24)19(25)23-11-17(18(12-23)20(26)27-3)14-5-7-15(21)8-6-14/h5-8,10,17-18H,4,9,11-12H2,1-3H3/t17-,18+/m1/s1