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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2,4-dinitro-aniline Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2,4-dinitro-aniline CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2,4-dinitroaniline IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2,4-dinitroaniline Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl-(2,4-dinitrophenyl)-methyl-amine Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC1COC2=CC=CC=C2O1)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O6/c1-17(9-12-10-24-15-4-2-3-5-16(15)25-12)13-7-6-11(18(20)21)8-14(13)19(22)23/h2-8,12H,9-10H2,1H3