6-(3-bromophenyl)-2-methyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-bromophenyl)-2-methyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyridine-3-carboxamide Openeye Name: 6-(3-bromophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-pyridine-3-carboxamide CAS Name: 6-(3-bromophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-3-pyridinecarboxamide IUPAC Name: 6-(3-bromophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methylpyridine-3-carboxamide Traditional Name: 6-(3-bromophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-nicotinamide Formula: C21H18BrN3O4 MolecularWeight: 456.28932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H18BrN3O4/c1-13-18(9-10-19(24-13)15-3-2-4-16(22)11-15)21(27)23-12-20(26)14-5-7-17(8-6-14)25(28)29/h2-11,20,26H,12H2,1H3,(H,23,27)