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

Systemtic Name: 4-(4-chlorophenyl)-3-(2-phenylethanimidoyl)-1,2,3-oxadiazol-3-ium-5-olate hydrochloride Openeye Name: 4-(4-chlorophenyl)-3-(2-phenylethanimidoyl)oxadiazol-3-ium-5-olate hydrochloride CAS Name: 4-(4-chlorophenyl)-3-(1-imino-2-phenylethyl)-5-oxadiazol-3-iumolate hydrochloride IUPAC Name: 4-(4-chlorophenyl)-3-(2-phenylethanimidoyl)oxadiazol-3-ium-5-olate hydrochloride Traditional Name: 4-(4-chlorophenyl)-3-(2-phenylacetimidoyl)oxadiazol-3-ium-5-olate hydrochloride Formula: C16H13Cl2N3O2 MolecularWeight: 350.19932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=N)[N+]2=NOC(=C2C3=CC=C(C=C3)Cl)[O-].Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(=N)[N+]2=NOC(=C2C3=CC=C(C=C3)Cl)[O-].Cl

InChI

InChI=1S/C16H12ClN3O2.ClH/c17-13-8-6-12(7-9-13)15-16(21)22-19-20(15)14(18)10-11-4-2-1-3-5-11;/h1-9,18H,10H2;1H