2-azanyl-4-(4-methoxyphenyl)-6-[4-(5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-3-yl)phenyl]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-methoxyphenyl)-6-[4-(5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-3-yl)phenyl]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-methoxyphenyl)-6-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-methoxyphenyl)-6-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(4-methoxyphenyl)-6-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]pyridine-3-carbonitrile Traditional Name: 2-amino-6-[4-(5-keto-2H-oxadiazol-3-ium-3-yl)phenyl]-4-(4-methoxyphenyl)nicotinonitrile Formula: C21H16N5O3+ MolecularWeight: 386.38344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)[N+]4=CC(=O)ON4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)[N+]4=CC(=O)ON4

InChI

InChI=1S/C21H15N5O3/c1-28-16-8-4-13(5-9-16)17-10-19(24-21(23)18(17)11-22)14-2-6-15(7-3-14)26-12-20(27)29-25-26/h2-10,12H,1H3,(H2-,23,24,25,27)/p+1