2-azanyl-4-(3-bromophenyl)-6-pyridin-1-ium-3-yl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-6-pyridin-1-ium-3-yl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromophenyl)-6-pyridin-1-ium-3-yl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromophenyl)-6-(3-pyridin-1-iumyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(3-bromophenyl)-6-pyridin-1-ium-3-ylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromophenyl)-6-pyridin-1-ium-3-yl-nicotinonitrile Formula: C17H12BrN4+ MolecularWeight: 352.20798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=CC(=NC(=C2C#N)N)C3=C[NH+]=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=CC(=NC(=C2C#N)N)C3=C[NH+]=CC=C3

InChI

InChI=1S/C17H11BrN4/c18-13-5-1-3-11(7-13)14-8-16(12-4-2-6-21-10-12)22-17(20)15(14)9-19/h1-8,10H,(H2,20,22)/p+1