methyl 1-(dimethylcarbamoyl)-3-(4-methylphenyl)sulfonyl-indole-4-carboxylate

Systemtic Name: methyl 1-(dimethylcarbamoyl)-3-(4-methylphenyl)sulfonyl-indole-4-carboxylate Openeye Name: methyl 1-(dimethylcarbamoyl)-3-(p-tolylsulfonyl)indole-4-carboxylate CAS Name: 1-[dimethylamino(oxo)methyl]-3-(4-methylphenyl)sulfonyl-4-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(dimethylcarbamoyl)-3-(4-methylphenyl)sulfonylindole-4-carboxylate Traditional Name: 1-(dimethylcarbamoyl)-3-tosyl-indole-4-carboxylic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC(=C32)C(=O)OC)C(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC(=C32)C(=O)OC)C(=O)N(C)C

InChI

InChI=1S/C20H20N2O5S/c1-13-8-10-14(11-9-13)28(25,26)17-12-22(20(24)21(2)3)16-7-5-6-15(18(16)17)19(23)27-4/h5-12H,1-4H3