3-[4-[5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[4-[5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-[4-[5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl]-2H-oxadiazol-3-ium-5-one CAS Name: 3-[4-[5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[4-[5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-[4-[5-(4-bromophenyl)-2-pyrazolin-3-yl]phenyl]-2H-oxadiazol-3-ium-5-one Formula: C17H14BrN4O2+ MolecularWeight: 386.22266

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NN=C1C2=CC=C(C=C2)[N+]3=CC(=O)ON3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C(NN=C1C2=CC=C(C=C2)[N+]3=CC(=O)ON3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H13BrN4O2/c18-13-5-1-11(2-6-13)15-9-16(20-19-15)12-3-7-14(8-4-12)22-10-17(23)24-21-22/h1-8,10,15H,9H2,(H-,19,21,23)/p+1