methyl 2-methyl-5-methylsulfonyl-4-pyrrol-1-yl-benzoate

Systemtic Name: methyl 2-methyl-5-methylsulfonyl-4-pyrrol-1-yl-benzoate Openeye Name: methyl 2-methyl-5-methylsulfonyl-4-pyrrol-1-yl-benzoate CAS Name: 2-methyl-5-methylsulfonyl-4-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-5-methylsulfonyl-4-pyrrol-1-ylbenzoate Traditional Name: 5-mesyl-2-methyl-4-pyrrol-1-yl-benzoic acid methyl ester Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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