ethyl 4-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butanoate

Systemtic Name: ethyl 4-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butanoate Openeye Name: ethyl 4-[1-(p-tolylsulfonyl)pyrrol-3-yl]butanoate CAS Name: 4-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]butanoate Traditional Name: 4-(1-tosylpyrrol-3-yl)butyric acid ethyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=CN(C=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CCCC1=CN(C=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H21NO4S/c1-3-22-17(19)6-4-5-15-11-12-18(13-15)23(20,21)16-9-7-14(2)8-10-16/h7-13H,3-6H2,1-2H3