ethyl 4-[2-[4-(4-chlorophenyl)-4-oxidanylidene-butanoyl]oxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[4-(4-chlorophenyl)-4-oxidanylidene-butanoyl]oxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[4-(4-chlorophenyl)-4-oxo-butanoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[4-(4-chlorophenyl)-1,4-dioxobutoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-chlorophenyl)-4-oxobutanoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[4-(4-chlorophenyl)-4-keto-butanoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H22ClNO6 MolecularWeight: 419.85548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl)C)C

InChI

InChI=1S/C21H22ClNO6/c1-4-28-21(27)20-13(3)23-12(2)19(20)17(25)11-29-18(26)10-9-16(24)14-5-7-15(22)8-6-14/h5-8,23H,4,9-11H2,1-3H3