diethyl 1-[2-[(4-chlorophenyl)amino]ethanoylamino]-2,5-dimethyl-pyrrole-3,4-dicarboxylate

Systemtic Name: diethyl 1-[2-[(4-chlorophenyl)amino]ethanoylamino]-2,5-dimethyl-pyrrole-3,4-dicarboxylate Openeye Name: diethyl 1-[[2-(4-chloroanilino)acetyl]amino]-2,5-dimethyl-pyrrole-3,4-dicarboxylate CAS Name: 1-[[2-(4-chloroanilino)-1-oxoethyl]amino]-2,5-dimethylpyrrole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[[2-(4-chloroanilino)acetyl]amino]-2,5-dimethylpyrrole-3,4-dicarboxylate Traditional Name: 1-[[2-(4-chloroanilino)acetyl]amino]-2,5-dimethyl-pyrrole-3,4-dicarboxylic acid diethyl ester Formula: C20H24ClN3O5 MolecularWeight: 421.87466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)NC(=O)CNC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)NC(=O)CNC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C20H24ClN3O5/c1-5-28-19(26)17-12(3)24(13(4)18(17)20(27)29-6-2)23-16(25)11-22-15-9-7-14(21)8-10-15/h7-10,22H,5-6,11H2,1-4H3,(H,23,25)