ethyl 5-(4-chlorophenyl)carbonyl-1-ethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)carbonyl-1-ethyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-chlorobenzoyl)-1-ethyl-pyrrole-3-carboxylate CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-1-ethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorobenzoyl)-1-ethylpyrrole-3-carboxylate Traditional Name: 5-(4-chlorobenzoyl)-1-ethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)C2=CC=C(C=C2)Cl)C(=O)OCC

Isomeric SMILES

CCN1C=C(C=C1C(=O)C2=CC=C(C=C2)Cl)C(=O)OCC

InChI

InChI=1S/C16H16ClNO3/c1-3-18-10-12(16(20)21-4-2)9-14(18)15(19)11-5-7-13(17)8-6-11/h5-10H,3-4H2,1-2H3