(2-nitrophenyl)methyl 1-methyl-4-sulfamoyl-pyrrole-2-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 1-methyl-4-sulfamoyl-pyrrole-2-carboxylate Openeye Name: (2-nitrophenyl)methyl 1-methyl-4-sulfamoyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-sulfamoyl-2-pyrrolecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 1-methyl-4-sulfamoylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-sulfamoyl-pyrrole-2-carboxylic acid (2-nitrobenzyl) ester Formula: C13H13N3O6S MolecularWeight: 339.32382

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C13H13N3O6S/c1-15-7-10(23(14,20)21)6-12(15)13(17)22-8-9-4-2-3-5-11(9)16(18)19/h2-7H,8H2,1H3,(H2,14,20,21)