butan-2-yl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate

Systemtic Name: butan-2-yl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate Openeye Name: sec-butyl 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate CAS Name: 1-(5-chloro-2-nitrophenyl)sulfonyl-2-pyrrolecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 1-(5-chloro-2-nitrophenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylic acid sec-butyl ester Formula: C15H15ClN2O6S MolecularWeight: 386.8074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN2O6S/c1-3-10(2)24-15(19)13-5-4-8-17(13)25(22,23)14-9-11(16)6-7-12(14)18(20)21/h4-10H,3H2,1-2H3