(1E)-4-methoxy-N-(5-methyl-6H-[1,2,3]oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate

Systemtic Name: (1E)-4-methoxy-N-(5-methyl-6H-[1,2,3]oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate Openeye Name: (1E)-4-methoxy-N-(5-methyl-6H-oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate CAS Name: (1E)-4-methoxy-N-(5-methyl-6H-oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate IUPAC Name: (1E)-4-methoxy-N-(5-methyl-6H-oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate Traditional Name: (1E)-4-methoxy-N-(5-methyl-6H-oxadiazolo[4,3-a]phthalazin-4-ium-1-yl)benzenecarboximidate Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2C3=C(ON=[N+]31)N=C(C4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

CN1CC2=CC=CC=C2C3=C(ON=[N+]31)/N=C(\C4=CC=C(C=C4)OC)/[O-]

InChI

InChI=1S/C18H16N4O3/c1-21-11-13-5-3-4-6-15(13)16-18(25-20-22(16)21)19-17(23)12-7-9-14(24-2)10-8-12/h3-10H,11H2,1-2H3