8-chloranyl-5-oxidanidyl-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium

Systemtic Name: 8-chloranyl-5-oxidanidyl-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 8-chloro-5-oxido-6-(2-pyridyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 8-chloro-5-oxido-6-(2-pyridinyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 8-chloro-5-oxido-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 8-chloro-5-oxido-6-(2-pyridyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C16H11ClN4O MolecularWeight: 310.73774

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=CN2C3=C(C=C(C=C3)Cl)C(=[N+]1[O-])C4=CC=CC=N4

Isomeric SMILES

C1C2=NC=CN2C3=C(C=C(C=C3)Cl)C(=[N+]1[O-])C4=CC=CC=N4

InChI

InChI=1S/C16H11ClN4O/c17-11-4-5-14-12(9-11)16(13-3-1-2-6-18-13)21(22)10-15-19-7-8-20(14)15/h1-9H,10H2