1-(3-nitrophenyl)-3-[3-(1-oxidanidylpyridin-1-ium-4-yl)-3-oxidanylidene-propyl]-1,8-naphthyridin-2-one

Systemtic Name: 1-(3-nitrophenyl)-3-[3-(1-oxidanidylpyridin-1-ium-4-yl)-3-oxidanylidene-propyl]-1,8-naphthyridin-2-one Openeye Name: 1-(3-nitrophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)-3-oxo-propyl]-1,8-naphthyridin-2-one CAS Name: 1-(3-nitrophenyl)-3-[3-(1-oxido-4-pyridin-1-iumyl)-3-oxopropyl]-1,8-naphthyridin-2-one IUPAC Name: 1-(3-nitrophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)-3-oxopropyl]-1,8-naphthyridin-2-one Traditional Name: 3-[3-keto-3-(1-oxidopyridin-1-ium-4-yl)propyl]-1-(3-nitrophenyl)-1,8-naphthyridin-2-one Formula: C22H16N4O5 MolecularWeight: 416.38624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C3=C(C=CC=N3)C=C(C2=O)CCC(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C3=C(C=CC=N3)C=C(C2=O)CCC(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C22H16N4O5/c27-20(15-8-11-24(29)12-9-15)7-6-17-13-16-3-2-10-23-21(16)25(22(17)28)18-4-1-5-19(14-18)26(30)31/h1-5,8-14H,6-7H2