ethyl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-ethanoyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-ethanoyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-acetyl-1-(5-chloro-2-nitro-phenyl)sulfonyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-(5-chloro-2-nitrophenyl)sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-1-(5-chloro-2-nitrophenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-(5-chloro-2-nitro-phenyl)sulfonyl-pyrrole-2-carboxylic acid ethyl ester Formula: C15H13ClN2O7S MolecularWeight: 400.79092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C15H13ClN2O7S/c1-3-25-15(20)13-6-10(9(2)19)8-17(13)26(23,24)14-7-11(16)4-5-12(14)18(21)22/h4-8H,3H2,1-2H3