N-[(5-nitrofuran-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-[(5-nitrofuran-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(5-nitro-2-furyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(5-nitro-2-furanyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(5-nitrofuran-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(5-nitro-2-furyl)methyl]amine Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCC3=CC=C(O3)[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCC3=CC=C(O3)[N+](=O)[O-])OC1

InChI

InChI=1S/C14H14N2O5/c17-16(18)14-5-3-11(21-14)9-15-10-2-4-12-13(8-10)20-7-1-6-19-12/h2-5,8,15H,1,6-7,9H2