(4-nitrophenyl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone

Systemtic Name: (4-nitrophenyl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Openeye Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-(4-nitrophenyl)methanone CAS Name: (4-nitrophenyl)-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]methanone IUPAC Name: (4-nitrophenyl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Traditional Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-(4-nitrophenyl)methanone Formula: C15H16N3O3+ MolecularWeight: 286.30584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O3/c1-11(2)16-14-5-3-4-10-17(14)15(19)12-6-8-13(9-7-12)18(20)21/h3-11H,1-2H3/p+1