ethyl 1-[2-(butanoylamino)-5-chloranyl-phenyl]sulfonylpyrrole-2-carboxylate

Systemtic Name: ethyl 1-[2-(butanoylamino)-5-chloranyl-phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[2-(butanoylamino)-5-chloro-phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[5-chloro-2-(1-oxobutylamino)phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(butanoylamino)-5-chlorophenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-(2-butyramido-5-chloro-phenyl)sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C17H19ClN2O5S MolecularWeight: 398.86116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

InChI

InChI=1S/C17H19ClN2O5S/c1-3-6-16(21)19-13-9-8-12(18)11-15(13)26(23,24)20-10-5-7-14(20)17(22)25-4-2/h5,7-11H,3-4,6H2,1-2H3,(H,19,21)