3-[1-(4-methoxyphenyl)-2H-1,2,3,4-tetrazol-1-ium-5-yl]quinolin-4-amine

Systemtic Name: 3-[1-(4-methoxyphenyl)-2H-1,2,3,4-tetrazol-1-ium-5-yl]quinolin-4-amine Openeye Name: 3-[1-(4-methoxyphenyl)-2H-tetrazol-1-ium-5-yl]quinolin-4-amine CAS Name: 3-[1-(4-methoxyphenyl)-2H-tetrazol-1-ium-5-yl]-4-quinolinamine IUPAC Name: 3-[1-(4-methoxyphenyl)-2H-tetrazol-1-ium-5-yl]quinolin-4-amine Traditional Name: [3-[1-(4-methoxyphenyl)-2H-tetrazol-1-ium-5-yl]-4-quinolyl]amine Formula: C17H15N6O+ MolecularWeight: 319.3406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2=C(N=NN2)C3=C(C4=CC=CC=C4N=C3)N

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2=C(N=NN2)C3=C(C4=CC=CC=C4N=C3)N

InChI

InChI=1S/C17H14N6O/c1-24-12-8-6-11(7-9-12)23-17(20-21-22-23)14-10-19-15-5-3-2-4-13(15)16(14)18/h2-10H,1H3,(H2,18,19,20,22)/p+1