methyl (2S,4S)-1-[(2-fluorophenyl)methyl]-4-(propanoylamino)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-1-[(2-fluorophenyl)methyl]-4-(propanoylamino)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-1-[(2-fluorophenyl)methyl]-4-(propanoylamino)pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-[(2-fluorophenyl)methyl]-4-(1-oxopropylamino)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-1-[(2-fluorophenyl)methyl]-4-(propanoylamino)pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-(2-fluorobenzyl)-4-propionamido-pyrrolidine-2-carboxylic acid methyl ester Formula: C16H21FN2O3 MolecularWeight: 308.347943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1CC(N(C1)CC2=CC=CC=C2F)C(=O)OC

Isomeric SMILES

CCC(=O)N[C@H]1C[C@H](N(C1)CC2=CC=CC=C2F)C(=O)OC

InChI

InChI=1S/C16H21FN2O3/c1-3-15(20)18-12-8-14(16(21)22-2)19(10-12)9-11-6-4-5-7-13(11)17/h4-7,12,14H,3,8-10H2,1-2H3,(H,18,20)/t12-,14-/m0/s1