methyl 2-methyl-5-methylsulfonyl-3-pyrrol-1-yl-benzoate

Systemtic Name: methyl 2-methyl-5-methylsulfonyl-3-pyrrol-1-yl-benzoate Openeye Name: methyl 2-methyl-5-methylsulfonyl-3-pyrrol-1-yl-benzoate CAS Name: 2-methyl-5-methylsulfonyl-3-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-5-methylsulfonyl-3-pyrrol-1-ylbenzoate Traditional Name: 5-mesyl-2-methyl-3-pyrrol-1-yl-benzoic acid methyl ester Formula: C14H15NO4S MolecularWeight: 293.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC=C2

InChI

InChI=1S/C14H15NO4S/c1-10-12(14(16)19-2)8-11(20(3,17)18)9-13(10)15-6-4-5-7-15/h4-9H,1-3H3