N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(5-methoxy-2-methyl-4-nitro-phenyl)acetamide CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(5-methoxy-2-methyl-4-nitro-phenyl)acetamide Formula: C22H20N3O5+ MolecularWeight: 406.4113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5/c1-15-12-19(25(28)29)20(30-2)13-18(15)23-21(26)14-24-10-8-17(9-11-24)22(27)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3/p+1