methyl 3-(4-chlorophenyl)carbonyl-2,4-dimethoxy-5-oxidanylidene-1-phenyl-pyrrole-2-carboxylate

Systemtic Name: methyl 3-(4-chlorophenyl)carbonyl-2,4-dimethoxy-5-oxidanylidene-1-phenyl-pyrrole-2-carboxylate Openeye Name: methyl 3-(4-chlorobenzoyl)-2,4-dimethoxy-5-oxo-1-phenyl-pyrrole-2-carboxylate CAS Name: 3-[(4-chlorophenyl)-oxomethyl]-2,4-dimethoxy-5-oxo-1-phenyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorobenzoyl)-2,4-dimethoxy-5-oxo-1-phenylpyrrole-2-carboxylate Traditional Name: 3-(4-chlorobenzoyl)-5-keto-2,4-dimethoxy-1-phenyl-3-pyrroline-2-carboxylic acid methyl ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(N(C1=O)C2=CC=CC=C2)(C(=O)OC)OC)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C(N(C1=O)C2=CC=CC=C2)(C(=O)OC)OC)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClNO6/c1-27-18-16(17(24)13-9-11-14(22)12-10-13)21(29-3,20(26)28-2)23(19(18)25)15-7-5-4-6-8-15/h4-12H,1-3H3