5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole CAS Name: 5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-1,2,4-triazole Formula: C15H10N4O4 MolecularWeight: 310.2643

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC=NN3C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC=NN3C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O4/c20-19(21)12-4-2-11(3-5-12)18-15(16-8-17-18)10-1-6-13-14(7-10)23-9-22-13/h1-8H,9H2