6-chloranyl-N-methyl-4-oxidanidyl-N-[(E)-pyridin-4-ylmethylideneamino]quinoxalin-4-ium-2-amine

Systemtic Name: 6-chloranyl-N-methyl-4-oxidanidyl-N-[(E)-pyridin-4-ylmethylideneamino]quinoxalin-4-ium-2-amine Openeye Name: 6-chloro-N-methyl-4-oxido-N-[(E)-4-pyridylmethyleneamino]quinoxalin-4-ium-2-amine CAS Name: 6-chloro-N-methyl-4-oxido-N-[(E)-pyridin-4-ylmethylideneamino]-2-quinoxalin-4-iumamine IUPAC Name: 6-chloro-N-methyl-4-oxido-N-[(E)-pyridin-4-ylmethylideneamino]quinoxalin-4-ium-2-amine Traditional Name: (6-chloro-4-oxido-quinoxalin-4-ium-2-yl)-methyl-[(E)-4-pyridylmethyleneamino]amine Formula: C15H12ClN5O MolecularWeight: 313.74168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C[N+](=C2C=C(C=CC2=N1)Cl)[O-])N=CC3=CC=NC=C3

Isomeric SMILES

CN(C1=C[N+](=C2C=C(C=CC2=N1)Cl)[O-])/N=C/C3=CC=NC=C3

InChI

InChI=1S/C15H12ClN5O/c1-20(18-9-11-4-6-17-7-5-11)15-10-21(22)14-8-12(16)2-3-13(14)19-15/h2-10H,1H3/b18-9+