N-[[3-nitro-4-(oxolan-2-ylmethoxy)phenyl]methyl]ethanamine

Systemtic Name: N-[[3-nitro-4-(oxolan-2-ylmethoxy)phenyl]methyl]ethanamine Openeye Name: N-[[3-nitro-4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]ethanamine CAS Name: N-[[3-nitro-4-(2-oxolanylmethoxy)phenyl]methyl]ethanamine IUPAC Name: N-[[3-nitro-4-(oxolan-2-ylmethoxy)phenyl]methyl]ethanamine Traditional Name: ethyl-[3-nitro-4-(tetrahydrofurfuryloxy)benzyl]amine Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)OCC2CCCO2)[N+](=O)[O-]

Isomeric SMILES

CCNCC1=CC(=C(C=C1)OCC2CCCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O4/c1-2-15-9-11-5-6-14(13(8-11)16(17)18)20-10-12-4-3-7-19-12/h5-6,8,12,15H,2-4,7,9-10H2,1H3