N-methyl-1-[5-nitro-2-(oxolan-2-ylmethoxy)phenyl]methanamine

Systemtic Name: N-methyl-1-[5-nitro-2-(oxolan-2-ylmethoxy)phenyl]methanamine Openeye Name: N-methyl-1-[5-nitro-2-(tetrahydrofuran-2-ylmethoxy)phenyl]methanamine CAS Name: N-methyl-1-[5-nitro-2-(2-oxolanylmethoxy)phenyl]methanamine IUPAC Name: N-methyl-1-[5-nitro-2-(oxolan-2-ylmethoxy)phenyl]methanamine Traditional Name: methyl-[5-nitro-2-(tetrahydrofurfuryloxy)benzyl]amine Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)[N+](=O)[O-])OCC2CCCO2

Isomeric SMILES

CNCC1=C(C=CC(=C1)[N+](=O)[O-])OCC2CCCO2

InChI

InChI=1S/C13H18N2O4/c1-14-8-10-7-11(15(16)17)4-5-13(10)19-9-12-3-2-6-18-12/h4-5,7,12,14H,2-3,6,8-9H2,1H3