8-bromanyl-6-(furan-2-yl)-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium

Systemtic Name: 8-bromanyl-6-(furan-2-yl)-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 8-bromo-6-(2-furyl)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 8-bromo-6-(2-furanyl)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 8-bromo-6-(furan-2-yl)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 8-bromo-6-(2-furyl)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C15H10BrN3O2 MolecularWeight: 344.1628

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=CN2C3=C(C=C(C=C3)Br)C(=[N+]1[O-])C4=CC=CO4

Isomeric SMILES

C1C2=NC=CN2C3=C(C=C(C=C3)Br)C(=[N+]1[O-])C4=CC=CO4

InChI

InChI=1S/C15H10BrN3O2/c16-10-3-4-12-11(8-10)15(13-2-1-7-21-13)19(20)9-14-17-5-6-18(12)14/h1-8H,9H2