7-bromanyl-5-pyridin-1-ium-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-5-pyridin-1-ium-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-5-pyridin-1-ium-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-bromo-5-(1-pyridin-1-iumyl)-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-5-pyridin-1-ium-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-pyridin-1-ium-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C14H11BrN3O+ MolecularWeight: 317.16064

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)[N+]3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)[N+]3=CC=CC=C3

InChI

InChI=1S/C14H10BrN3O/c15-10-4-5-12-11(8-10)14(16-9-13(19)17-12)18-6-2-1-3-7-18/h1-8H,9H2/p+1