N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2,4-dinitro-aniline

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2,4-dinitro-aniline Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2,4-dinitro-aniline CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2,4-dinitroaniline IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2,4-dinitroaniline Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(2,4-dinitrophenyl)-ethyl-amine Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCCO2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCCO2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-2-18(11-12-3-6-16-17(9-12)26-8-7-25-16)14-5-4-13(19(21)22)10-15(14)20(23)24/h3-6,9-10H,2,7-8,11H2,1H3