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

Systemtic Name: 1-(3-aminophenyl)-3-[3-(1-oxidanidylpyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Openeye Name: 1-(3-aminophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one CAS Name: 1-(3-aminophenyl)-3-[3-(1-oxido-4-pyridin-1-iumyl)butyl]-1,8-naphthyridin-2-one IUPAC Name: 1-(3-aminophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Traditional Name: 1-(3-aminophenyl)-3-[3-(1-oxidopyridin-1-ium-4-yl)butyl]-1,8-naphthyridin-2-one Formula: C23H22N4O2 MolecularWeight: 386.44638

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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)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O2/c1-16(17-9-12-26(29)13-10-17)7-8-19-14-18-4-3-11-25-22(18)27(23(19)28)21-6-2-5-20(24)15-21/h2-6,9-16H,7-8,24H2,1H3