3-(2-bromanyl-4-methyl-phenyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-olate

Systemtic Name: 3-(2-bromanyl-4-methyl-phenyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-olate Openeye Name: 3-(2-bromo-4-methyl-phenyl)triazolo[4,5-d]pyrimidin-7-olate CAS Name: 3-(2-bromo-4-methylphenyl)-7-triazolo[4,5-d]pyrimidinolate IUPAC Name: 3-(2-bromo-4-methylphenyl)triazolo[4,5-d]pyrimidin-7-olate Traditional Name: 3-(2-bromo-4-methyl-phenyl)triazolo[4,5-d]pyrimidin-7-olate Formula: C11H7BrN5O- MolecularWeight: 305.11018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C(=NC=N3)[O-])N=N2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C(=NC=N3)[O-])N=N2)Br

InChI

InChI=1S/C11H8BrN5O/c1-6-2-3-8(7(12)4-6)17-10-9(15-16-17)11(18)14-5-13-10/h2-5H,1H3,(H,13,14,18)/p-1