(phenylmethyl) 4-ethyl-1-(4-nitrophenyl)sulfonyl-5-oxidanylidene-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 4-ethyl-1-(4-nitrophenyl)sulfonyl-5-oxidanylidene-pyrrolidine-2-carboxylate Openeye Name: benzyl 4-ethyl-1-(4-nitrophenyl)sulfonyl-5-oxo-pyrrolidine-2-carboxylate CAS Name: 4-ethyl-1-(4-nitrophenyl)sulfonyl-5-oxo-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-ethyl-1-(4-nitrophenyl)sulfonyl-5-oxopyrrolidine-2-carboxylate Traditional Name: 4-ethyl-5-keto-1-nosyl-pyrrolidine-2-carboxylic acid benzyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(N(C1=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1CC(N(C1=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O7S/c1-2-15-12-18(20(24)29-13-14-6-4-3-5-7-14)21(19(15)23)30(27,28)17-10-8-16(9-11-17)22(25)26/h3-11,15,18H,2,12-13H2,1H3