4-isoquinolin-2-ium-2-yl-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide

Systemtic Name: 4-isoquinolin-2-ium-2-yl-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide Openeye Name: N1,N3-dihydroxy-4-isoquinolin-2-ium-2-yl-benzene-1,3-diamine oxide CAS Name: N1,N3-dihydroxy-4-(2-isoquinolin-2-iumyl)benzene-1,3-diamine oxide IUPAC Name: 1-N,3-N-dihydroxy-4-isoquinolin-2-ium-2-ylbenzene-1,3-diamine oxide Traditional Name: N,N'-dihydroxy-4-isoquinolin-2-ium-2-yl-benzene-1,3-diamine oxide Formula: C15H14N3O4+ MolecularWeight: 300.28936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)C3=C(C=C(C=C3)[NH+](O)[O-])[NH+](O)[O-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)C3=C(C=C(C=C3)[NH+](O)[O-])[NH+](O)[O-]

InChI

InChI=1S/C15H14N3O4/c19-17(20)13-5-6-14(15(9-13)18(21)22)16-8-7-11-3-1-2-4-12(11)10-16/h1-10,17-19,21H/q+1