ethyl 5-(4-methylphenyl)carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-methylphenyl)carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-methylbenzoyl)-1H-pyrrole-3-carboxylate CAS Name: 5-[(4-methylphenyl)-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methylbenzoyl)-1H-pyrrole-3-carboxylate Traditional Name: 5-p-toluoyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC(=C1)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CNC(=C1)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H15NO3/c1-3-19-15(18)12-8-13(16-9-12)14(17)11-6-4-10(2)5-7-11/h4-9,16H,3H2,1-2H3