methyl 3-oxidanylidene-4-[1-(phenylsulfonyl)pyrrol-2-yl]butanoate

Systemtic Name: methyl 3-oxidanylidene-4-[1-(phenylsulfonyl)pyrrol-2-yl]butanoate Openeye Name: methyl 4-[1-(benzenesulfonyl)pyrrol-2-yl]-3-oxo-butanoate CAS Name: 4-[1-(benzenesulfonyl)-2-pyrrolyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[1-(benzenesulfonyl)pyrrol-2-yl]-3-oxobutanoate Traditional Name: 4-(1-besylpyrrol-2-yl)-3-keto-butyric acid methyl ester Formula: C15H15NO5S MolecularWeight: 321.3483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CC1=CC=CN1S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(=O)CC1=CC=CN1S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H15NO5S/c1-21-15(18)11-13(17)10-12-6-5-9-16(12)22(19,20)14-7-3-2-4-8-14/h2-9H,10-11H2,1H3