5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium

Systemtic Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium Openeye Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium CAS Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium IUPAC Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium Traditional Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-1,3,4-thiadiazol-3-ium Formula: C15H12N3O3S+ MolecularWeight: 314.33908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=N[N+](=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=N[N+](=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N3O3S/c1-21-14-8-2-11(3-9-14)15-16-17(10-22-15)12-4-6-13(7-5-12)18(19)20/h2-10H,1H3/q+1