methyl 2-[[4-(phenylsulfonyl)-1H-pyrrol-3-yl]sulfonyl]ethanoate

Systemtic Name: methyl 2-[[4-(phenylsulfonyl)-1H-pyrrol-3-yl]sulfonyl]ethanoate Openeye Name: methyl 2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]acetate CAS Name: 2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]acetate Traditional Name: 2-[(4-besyl-1H-pyrrol-3-yl)sulfonyl]acetic acid methyl ester Formula: C13H13NO6S2 MolecularWeight: 343.37542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)C1=CNC=C1S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CS(=O)(=O)C1=CNC=C1S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13NO6S2/c1-20-13(15)9-21(16,17)11-7-14-8-12(11)22(18,19)10-5-3-2-4-6-10/h2-8,14H,9H2,1H3