ethyl 5-(4-chlorophenyl)carbonyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-4-ethyl-1-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)carbonyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-4-ethyl-1-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxo-ethyl)-4-ethyl-1-methyl-pyrrole-3-carboxylate CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-2-(2-ethoxy-2-oxoethyl)-4-ethyl-1-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxoethyl)-4-ethyl-1-methylpyrrole-3-carboxylate Traditional Name: 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-keto-ethyl)-4-ethyl-1-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=C1C(=O)OCC)CC(=O)OCC)C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=C(N(C(=C1C(=O)OCC)CC(=O)OCC)C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO5/c1-5-15-18(21(26)28-7-3)16(12-17(24)27-6-2)23(4)19(15)20(25)13-8-10-14(22)11-9-13/h8-11H,5-7,12H2,1-4H3