5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium

Systemtic Name: 5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium Openeye Name: 5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium CAS Name: 5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium IUPAC Name: 5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium Traditional Name: 5,6,7-trimethyl-2-phenyl-[1,3,4]oxadiazolo[3,2-a]pyrimidin-4-ium Formula: C14H14N3O+ MolecularWeight: 240.28046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2[N+](=C1C)N=C(O2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N=C2[N+](=C1C)N=C(O2)C3=CC=CC=C3)C

InChI

InChI=1S/C14H14N3O/c1-9-10(2)15-14-17(11(9)3)16-13(18-14)12-7-5-4-6-8-12/h4-8H,1-3H3/q+1