N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H12BrN5O5 MolecularWeight: 446.21168

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrN5O5/c18-11-6-15-16(28-4-3-27-15)7-12(11)21-17(24)10-1-2-13(14(5-10)23(25)26)22-9-19-8-20-22/h1-2,5-9H,3-4H2,(H,21,24)