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

Systemtic Name: methyl 2-methoxy-5-methylsulfonyl-3-pyrrol-1-yl-benzoate Openeye Name: methyl 2-methoxy-5-methylsulfonyl-3-pyrrol-1-yl-benzoate CAS Name: 2-methoxy-5-methylsulfonyl-3-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-methylsulfonyl-3-pyrrol-1-ylbenzoate Traditional Name: 5-mesyl-2-methoxy-3-pyrrol-1-yl-benzoic acid methyl ester Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC=C2

InChI

InChI=1S/C14H15NO5S/c1-19-13-11(14(16)20-2)8-10(21(3,17)18)9-12(13)15-6-4-5-7-15/h4-9H,1-3H3