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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dinitro-aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dinitro-aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dinitroaniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-piperonyl-amine Formula: C14H11N3O6 MolecularWeight: 317.25364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O6/c18-16(19)10-2-3-11(12(6-10)17(20)21)15-7-9-1-4-13-14(5-9)23-8-22-13/h1-6,15H,7-8H2