ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-1,4-dimethyl-5-(4-methylphenyl)carbonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-1,4-dimethyl-5-(4-methylphenyl)carbonyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-(2-ethoxy-2-oxo-ethyl)-1,4-dimethyl-5-(4-methylbenzoyl)pyrrole-3-carboxylate CAS Name: 2-(2-ethoxy-2-oxoethyl)-1,4-dimethyl-5-[(4-methylphenyl)-oxomethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-ethoxy-2-oxoethyl)-1,4-dimethyl-5-(4-methylbenzoyl)pyrrole-3-carboxylate Traditional Name: 2-(2-ethoxy-2-keto-ethyl)-1,4-dimethyl-5-p-toluoyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=C(C=C2)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=C(C=C2)C)C)C(=O)OCC

InChI

InChI=1S/C21H25NO5/c1-6-26-17(23)12-16-18(21(25)27-7-2)14(4)19(22(16)5)20(24)15-10-8-13(3)9-11-15/h8-11H,6-7,12H2,1-5H3