(4-nitrophenyl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylic acid (4-nitrobenzyl) ester Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O6S/c19-14-5-9-16(10-6-14)28(25,26)20-11-1-2-17(20)18(22)27-12-13-3-7-15(8-4-13)21(23)24/h3-10,17H,1-2,11-12H2