3-(4-methoxyphenyl)-4-(2-phenyl-1,3-thiazol-4-yl)-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(4-methoxyphenyl)-4-(2-phenyl-1,3-thiazol-4-yl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(4-methoxyphenyl)-4-(2-phenylthiazol-4-yl)oxadiazol-3-ium-5-olate CAS Name: 3-(4-methoxyphenyl)-4-(2-phenyl-4-thiazolyl)-5-oxadiazol-3-iumolate IUPAC Name: 3-(4-methoxyphenyl)-4-(2-phenyl-1,3-thiazol-4-yl)oxadiazol-3-ium-5-olate Traditional Name: 3-(4-methoxyphenyl)-4-(2-phenylthiazol-4-yl)oxadiazol-3-ium-5-olate Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2=NOC(=C2C3=CSC(=N3)C4=CC=CC=C4)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2=NOC(=C2C3=CSC(=N3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C18H13N3O3S/c1-23-14-9-7-13(8-10-14)21-16(18(22)24-20-21)15-11-25-17(19-15)12-5-3-2-4-6-12/h2-11H,1H3