N-[(3-fluorophenyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine

Systemtic Name: N-[(3-fluorophenyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine Openeye Name: N-[(3-fluorophenyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine CAS Name: N-[(3-fluorophenyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine IUPAC Name: N-[(3-fluorophenyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine Traditional Name: ethyl-(3-fluorobenzyl)-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amine Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C18H19FN2O4/c1-2-20(9-13-4-3-5-16(19)6-13)10-14-7-17(21(22)23)8-15-11-24-12-25-18(14)15/h3-8H,2,9-12H2,1H3