methyl 4-(2-chlorophenyl)carbonyl-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)carbonyl-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(2-chlorobenzoyl)-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorobenzoyl)-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-chlorobenzoyl)-2-(methoxymethyl)-5-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H16ClNO4 MolecularWeight: 321.75554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)COC)C(=O)OC)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C(=C(N1)COC)C(=O)OC)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H16ClNO4/c1-9-13(15(19)10-6-4-5-7-11(10)17)14(16(20)22-3)12(18-9)8-21-2/h4-7,18H,8H2,1-3H3