N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2,4-dinitro-aniline

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2,4-dinitro-aniline Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2,4-dinitro-aniline CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2,4-dinitroaniline IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2,4-dinitroaniline Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2,4-dinitrophenyl)amine Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O6/c20-18(21)12-2-3-13(14(10-12)19(22)23)17-6-5-11-1-4-15-16(9-11)25-8-7-24-15/h1-4,9-10,17H,5-8H2