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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O5/c1-15(22(27)23-19-14-18(25(28)29)8-9-20(19)30-2)24-12-10-17(11-13-24)21(26)16-6-4-3-5-7-16/h3-15H,1-2H3/p+1/t15-/m1/s1