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

Systemtic Name: ethyl 1-[2-(butylamino)-5-chloranyl-phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[2-(butylamino)-5-chloro-phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[2-(butylamino)-5-chlorophenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(butylamino)-5-chlorophenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[2-(butylamino)-5-chloro-phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C17H21ClN2O4S MolecularWeight: 384.87764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

InChI

InChI=1S/C17H21ClN2O4S/c1-3-5-10-19-14-9-8-13(18)12-16(14)25(22,23)20-11-6-7-15(20)17(21)24-4-2/h6-9,11-12,19H,3-5,10H2,1-2H3