(4-nitrophenyl)methyl 2-(1,3-dithiolan-2-yl)pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(1,3-dithiolan-2-yl)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(1,3-dithiolan-2-yl)pyrrolidine-1-carboxylate CAS Name: 2-(1,3-dithiolan-2-yl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(1,3-dithiolan-2-yl)pyrrolidine-1-carboxylate Traditional Name: 2-(1,3-dithiolan-2-yl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C15H18N2O4S2 MolecularWeight: 354.44442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3SCCS3

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3SCCS3

InChI

InChI=1S/C15H18N2O4S2/c18-15(16-7-1-2-13(16)14-22-8-9-23-14)21-10-11-3-5-12(6-4-11)17(19)20/h3-6,13-14H,1-2,7-10H2