ethyl 4-[[2,5-bis(chloranyl)phenyl]methyl]-5-methanoyl-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[[2,5-bis(chloranyl)phenyl]methyl]-5-methanoyl-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(2,5-dichlorophenyl)methyl]-5-formyl-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(2,5-dichlorophenyl)methyl]-5-formyl-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,5-dichlorophenyl)methyl]-5-formyl-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(2,5-dichlorobenzyl)-5-formyl-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H15Cl2NO3 MolecularWeight: 340.2012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1CC2=C(C=CC(=C2)Cl)Cl)C=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1CC2=C(C=CC(=C2)Cl)Cl)C=O)C

InChI

InChI=1S/C16H15Cl2NO3/c1-3-22-16(21)15-9(2)19-14(8-20)12(15)7-10-6-11(17)4-5-13(10)18/h4-6,8,19H,3,7H2,1-2H3