methyl 4-(5-acetamido-2-chloranyl-phenyl)carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(5-acetamido-2-chloranyl-phenyl)carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(5-acetamido-2-chloro-benzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(5-acetamido-2-chlorophenyl)-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-acetamido-2-chlorobenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(5-acetamido-2-chloro-benzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17ClN2O4 MolecularWeight: 348.78088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=C(C=CC(=C2)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=C(C=CC(=C2)NC(=O)C)Cl

InChI

InChI=1S/C17H17ClN2O4/c1-8-14(15(9(2)19-8)17(23)24-4)16(22)12-7-11(20-10(3)21)5-6-13(12)18/h5-7,19H,1-4H3,(H,20,21)