ethyl 3-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3-(4-methoxyphenyl)-4-methyl-5-(p-tolylsulfonyl)-1H-pyrrole-2-carboxylate CAS Name: 3-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 3-(4-methoxyphenyl)-4-methyl-5-tosyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)S(=O)(=O)C2=CC=C(C=C2)C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)S(=O)(=O)C2=CC=C(C=C2)C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23NO5S/c1-5-28-22(24)20-19(16-8-10-17(27-4)11-9-16)15(3)21(23-20)29(25,26)18-12-6-14(2)7-13-18/h6-13,23H,5H2,1-4H3