N-(1,3-benzodioxol-5-ylmethyl)-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-piperonyl-amine Formula: C15H11F3N2O4 MolecularWeight: 340.25405

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11F3N2O4/c16-15(17,18)10-2-3-11(12(6-10)20(21)22)19-7-9-1-4-13-14(5-9)24-8-23-13/h1-6,19H,7-8H2