methyl 4-[(E)-3-(dimethylamino)-2-methyl-prop-2-enoyl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[(E)-3-(dimethylamino)-2-methyl-prop-2-enoyl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[(E)-3-(dimethylamino)-2-methyl-prop-2-enoyl]-1-(p-tolylsulfonyl)pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(dimethylamino)-2-methyl-1-oxoprop-2-enyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(dimethylamino)-2-methylprop-2-enoyl]-1-(4-methylphenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(dimethylamino)-2-methyl-acryloyl]-1-tosyl-pyrrole-2-carboxylic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C=C2C(=O)OC)C(=O)C(=CN(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C=C2C(=O)OC)C(=O)/C(=C/N(C)C)/C

InChI

InChI=1S/C19H22N2O5S/c1-13-6-8-16(9-7-13)27(24,25)21-12-15(10-17(21)19(23)26-5)18(22)14(2)11-20(3)4/h6-12H,1-5H3/b14-11+