4-(4-ethanoylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: 4-(4-ethanoylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: 4-(4-acetylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-(4-acetylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate IUPAC Name: 4-(4-acetylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(4-acetylphenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Formula: C15H14NO3- MolecularWeight: 256.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)[O-])C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)[O-])C2=CC=C(C=C2)C(=O)C

InChI

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