2-bromanyl-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide

Systemtic Name: 2-bromanyl-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide Openeye Name: 2-bromo-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide CAS Name: 2-bromo-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide IUPAC Name: 2-bromo-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide Traditional Name: 2-bromo-3,4,5-trimethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide Formula: C12H13BrN4O4 MolecularWeight: 357.16002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=NC=NN2)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=NC=NN2)Br)OC)OC

InChI

InChI=1S/C12H13BrN4O4/c1-19-7-4-6(8(13)10(21-3)9(7)20-2)11(18)16-12-14-5-15-17-12/h4-5H,1-3H3,(H2,14,15,16,17,18)