3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-ylidene]amino]propan-1-ol

Systemtic Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-ylidene]amino]propan-1-ol Openeye Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-5-nitro-triazol-4-ylidene]amino]propan-1-ol CAS Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-5-nitro-4-triazolylidene]amino]-1-propanol IUPAC Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-5-nitrotriazol-4-ylidene]amino]propan-1-ol Traditional Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-5-nitro-triazol-4-ylidene]amino]propan-1-ol Formula: C13H15N5O6 MolecularWeight: 337.2881

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3N=C(C(=NCCCO)N3O)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3N=C(C(=NCCCO)N3O)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O6/c19-5-1-4-14-12-13(18(21)22)15-16(17(12)20)9-2-3-10-11(8-9)24-7-6-23-10/h2-3,8,19-20H,1,4-7H2