6-(4-bromophenyl)-3-methyl-4-oxidanidyl-1-phenyl-pyrazolo[3,4-b]pyrazin-4-ium

Systemtic Name: 6-(4-bromophenyl)-3-methyl-4-oxidanidyl-1-phenyl-pyrazolo[3,4-b]pyrazin-4-ium Openeye Name: 6-(4-bromophenyl)-3-methyl-4-oxido-1-phenyl-pyrazolo[3,4-b]pyrazin-4-ium CAS Name: 6-(4-bromophenyl)-3-methyl-4-oxido-1-phenylpyrazolo[3,4-b]pyrazin-4-ium IUPAC Name: 6-(4-bromophenyl)-3-methyl-4-oxido-1-phenylpyrazolo[3,4-b]pyrazin-4-ium Traditional Name: 6-(4-bromophenyl)-3-methyl-4-oxido-1-phenyl-pyrazolo[3,4-b]pyrazin-4-ium Formula: C18H13BrN4O MolecularWeight: 381.22602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=C[N+](=C12)[O-])C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=NC(=C[N+](=C12)[O-])C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C18H13BrN4O/c1-12-17-18(23(21-12)15-5-3-2-4-6-15)20-16(11-22(17)24)13-7-9-14(19)10-8-13/h2-11H,1H3