(4-nitrophenyl)methyl 2-(aminocarbonyloxymethyl)-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(aminocarbonyloxymethyl)-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(carbamoyloxymethyl)-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-(carbamoyloxymethyl)-4-mercapto-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(carbamoyloxymethyl)-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(carbamoyloxymethyl)-4-mercapto-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C14H17N3O6S MolecularWeight: 355.36628

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1COC(=O)N)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S

Isomeric SMILES

C1C(CN(C1COC(=O)N)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S

InChI

InChI=1S/C14H17N3O6S/c15-13(18)22-8-11-5-12(24)6-16(11)14(19)23-7-9-1-3-10(4-2-9)17(20)21/h1-4,11-12,24H,5-8H2,(H2,15,18)