[2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] 6-acetamidopyridine-2-carboxylate

Systemtic Name: [2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] 6-acetamidopyridine-2-carboxylate Openeye Name: [2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl] 6-acetamidopyridine-2-carboxylate CAS Name: 6-acetamido-2-pyridinecarboxylic acid [2-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 6-acetamidopyridine-2-carboxylate Traditional Name: 6-acetamidopicolinic acid [2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl] ester Formula: C22H20BrN3O4 MolecularWeight: 470.3159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)COC(=O)C3=NC(=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)COC(=O)C3=NC(=CC=C3)NC(=O)C

InChI

InChI=1S/C22H20BrN3O4/c1-13-11-18(14(2)26(13)17-9-7-16(23)8-10-17)20(28)12-30-22(29)19-5-4-6-21(25-19)24-15(3)27/h4-11H,12H2,1-3H3,(H,24,25,27)