N-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-propanamide bromide

Systemtic Name: N-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-propanamide bromide Openeye Name: N-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-propanamide bromide CAS Name: N-(3-nitrophenyl)-2-(1-pyridin-1-iumyl)propanamide bromide IUPAC Name: N-(3-nitrophenyl)-2-pyridin-1-ium-1-ylpropanamide bromide Traditional Name: N-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-propionamide bromide Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])[N+]2=CC=CC=C2.[Br-]

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])[N+]2=CC=CC=C2.[Br-]

InChI

InChI=1S/C14H13N3O3.BrH/c1-11(16-8-3-2-4-9-16)14(18)15-12-6-5-7-13(10-12)17(19)20;/h2-11H,1H3;1H