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

Systemtic Name: 1-(3-nitrophenyl)-3-[3-(1-oxidanidylpyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Openeye Name: 1-(3-nitrophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one CAS Name: 1-(3-nitrophenyl)-3-[3-(1-oxido-4-pyridin-1-iumyl)butyl]-1,8-naphthyridin-2-one IUPAC Name: 1-(3-nitrophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Traditional Name: 1-(3-nitrophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(N=CC=C2)N(C1=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

CC(CCC1=CC2=C(N=CC=C2)N(C1=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C23H20N4O4/c1-16(17-9-12-25(29)13-10-17)7-8-19-14-18-4-3-11-24-22(18)26(23(19)28)20-5-2-6-21(15-20)27(30)31/h2-6,9-16H,7-8H2,1H3