4-(4-methoxyphenyl)-3-(2-phenylethanimidoyl)-1,2,3-oxadiazol-3-ium-5-olate hydrochloride

Systemtic Name: 4-(4-methoxyphenyl)-3-(2-phenylethanimidoyl)-1,2,3-oxadiazol-3-ium-5-olate hydrochloride Openeye Name: 4-(4-methoxyphenyl)-3-(2-phenylethanimidoyl)oxadiazol-3-ium-5-olate hydrochloride CAS Name: 3-(1-imino-2-phenylethyl)-4-(4-methoxyphenyl)-5-oxadiazol-3-iumolate hydrochloride IUPAC Name: 4-(4-methoxyphenyl)-3-(2-phenylethanimidoyl)oxadiazol-3-ium-5-olate hydrochloride Traditional Name: 4-(4-methoxyphenyl)-3-(2-phenylacetimidoyl)oxadiazol-3-ium-5-olate hydrochloride Formula: C17H16ClN3O3 MolecularWeight: 345.78024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(ON=[N+]2C(=N)CC3=CC=CC=C3)[O-].Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(ON=[N+]2C(=N)CC3=CC=CC=C3)[O-].Cl

InChI

InChI=1S/C17H15N3O3.ClH/c1-22-14-9-7-13(8-10-14)16-17(21)23-19-20(16)15(18)11-12-5-3-2-4-6-12;/h2-10,18H,11H2,1H3;1H