1-methyl-3-nitro-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-2-one

Systemtic Name: 1-methyl-3-nitro-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-2-one Openeye Name: 1-methyl-3-nitro-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-2-one CAS Name: 1-methyl-3-nitro-4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-quinolinone IUPAC Name: 1-methyl-3-nitro-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-2-one Traditional Name: 1-methyl-3-nitro-4-(4-pyridin-1-ium-2-ylpiperazino)carbostyril Formula: C19H20N5O3+ MolecularWeight: 366.3938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H19N5O3/c1-21-15-7-3-2-6-14(15)17(18(19(21)25)24(26)27)23-12-10-22(11-13-23)16-8-4-5-9-20-16/h2-9H,10-13H2,1H3/p+1