7-chloranyl-3-(3-imidazol-1-ylpropylimino)-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 7-chloranyl-3-(3-imidazol-1-ylpropylimino)-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile Openeye Name: 7-chloro-4-hydroxy-3-(3-imidazol-1-ylpropylimino)-1-oxido-quinoxalin-1-ium-2-carbonitrile CAS Name: 7-chloro-4-hydroxy-3-[3-(1-imidazolyl)propylimino]-1-oxido-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 7-chloro-4-hydroxy-3-(3-imidazol-1-ylpropylimino)-1-oxidoquinoxalin-1-ium-2-carbonitrile Traditional Name: 7-chloro-4-hydroxy-3-(3-imidazol-1-ylpropylimino)-1-oxido-quinoxalin-1-ium-2-carbonitrile Formula: C15H13ClN6O2 MolecularWeight: 344.75572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)[N+](=C(C(=NCCCN3C=CN=C3)N2O)C#N)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)[N+](=C(C(=NCCCN3C=CN=C3)N2O)C#N)[O-]

InChI

InChI=1S/C15H13ClN6O2/c16-11-2-3-12-13(8-11)21(23)14(9-17)15(22(12)24)19-4-1-6-20-7-5-18-10-20/h2-3,5,7-8,10,24H,1,4,6H2