(4-nitrophenyl)methyl 2-(1,2,4-oxadiazol-5-yl)-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(1,2,4-oxadiazol-5-yl)-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(1,2,4-oxadiazol-5-yl)-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: 4-mercapto-2-(1,2,4-oxadiazol-5-yl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(1,2,4-oxadiazol-5-yl)-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: 4-mercapto-2-(1,2,4-oxadiazol-5-yl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C14H14N4O5S MolecularWeight: 350.34976

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C2=NC=NO2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])S

Isomeric SMILES

C1C(CN(C1C2=NC=NO2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])S

InChI

InChI=1S/C14H14N4O5S/c19-14(22-7-9-1-3-10(4-2-9)18(20)21)17-6-11(24)5-12(17)13-15-8-16-23-13/h1-4,8,11-12,24H,5-7H2