1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole

Systemtic Name: 1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole Openeye Name: 1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole CAS Name: 1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole IUPAC Name: 1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole Traditional Name: 1-[2-ethoxy-3,3-dimethyl-1-(4-nitrophenoxy)pentyl]-1,2,4-triazole Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)[N+](=O)[O-])OCC

Isomeric SMILES

CCC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)[N+](=O)[O-])OCC

InChI

InChI=1S/C17H24N4O4/c1-5-17(3,4)15(24-6-2)16(20-12-18-11-19-20)25-14-9-7-13(8-10-14)21(22)23/h7-12,15-16H,5-6H2,1-4H3