ethyl 2-[(3,4-dimethylphenyl)amino]-5-(phenylcarbonyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-[(3,4-dimethylphenyl)amino]-5-(phenylcarbonyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-benzoyl-2-(3,4-dimethylanilino)-1H-pyrrole-3-carboxylate CAS Name: 5-benzoyl-2-(3,4-dimethylanilino)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-benzoyl-2-(3,4-dimethylanilino)-1H-pyrrole-3-carboxylate Traditional Name: 5-benzoyl-2-(3,4-dimethylanilino)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1)C(=O)C2=CC=CC=C2)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1)C(=O)C2=CC=CC=C2)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H22N2O3/c1-4-27-22(26)18-13-19(20(25)16-8-6-5-7-9-16)24-21(18)23-17-11-10-14(2)15(3)12-17/h5-13,23-24H,4H2,1-3H3