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

Systemtic Name: ethyl 1-[5-chloranyl-2-(hexanoylamino)phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[5-chloro-2-(hexanoylamino)phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[5-chloro-2-(1-oxohexylamino)phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-2-(hexanoylamino)phenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[2-(caproylamino)-5-chloro-phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C19H23ClN2O5S MolecularWeight: 426.91432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23ClN2O5S/c1-3-5-6-9-18(23)21-15-11-10-14(20)13-17(15)28(25,26)22-12-7-8-16(22)19(24)27-4-2/h7-8,10-13H,3-6,9H2,1-2H3,(H,21,23)