6-bromanyl-N-[(3-nitro-1,2,4-triazol-1-yl)methyl]quinolin-8-amine

Systemtic Name: 6-bromanyl-N-[(3-nitro-1,2,4-triazol-1-yl)methyl]quinolin-8-amine Openeye Name: 6-bromo-N-[(3-nitro-1,2,4-triazol-1-yl)methyl]quinolin-8-amine CAS Name: 6-bromo-N-[(3-nitro-1,2,4-triazol-1-yl)methyl]-8-quinolinamine IUPAC Name: 6-bromo-N-[(3-nitro-1,2,4-triazol-1-yl)methyl]quinolin-8-amine Traditional Name: (6-bromo-8-quinolyl)-[(3-nitro-1,2,4-triazol-1-yl)methyl]amine Formula: C12H9BrN6O2 MolecularWeight: 349.14286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC(=C2N=C1)NCN3C=NC(=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC2=CC(=CC(=C2N=C1)NCN3C=NC(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C12H9BrN6O2/c13-9-4-8-2-1-3-14-11(8)10(5-9)15-6-18-7-16-12(17-18)19(20)21/h1-5,7,15H,6H2