cyclohexyl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate

Systemtic Name: cyclohexyl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate Openeye Name: cyclohexyl 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate CAS Name: 1-(5-chloro-2-nitrophenyl)sulfonyl-2-pyrrolecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-(5-chloro-2-nitrophenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylic acid cyclohexyl ester Formula: C17H17ClN2O6S MolecularWeight: 412.84468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=CN2S(=O)(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=CN2S(=O)(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O6S/c18-12-8-9-14(20(22)23)16(11-12)27(24,25)19-10-4-7-15(19)17(21)26-13-5-2-1-3-6-13/h4,7-11,13H,1-3,5-6H2