N-[(5-nitro-2-pentoxy-phenyl)methyl]ethanamine

Systemtic Name: N-[(5-nitro-2-pentoxy-phenyl)methyl]ethanamine Openeye Name: N-[(5-nitro-2-pentoxy-phenyl)methyl]ethanamine CAS Name: N-[(5-nitro-2-pentoxyphenyl)methyl]ethanamine IUPAC Name: N-[(5-nitro-2-pentoxyphenyl)methyl]ethanamine Traditional Name: (2-amoxy-5-nitro-benzyl)-ethyl-amine Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])CNCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])CNCC

InChI

InChI=1S/C14H22N2O3/c1-3-5-6-9-19-14-8-7-13(16(17)18)10-12(14)11-15-4-2/h7-8,10,15H,3-6,9,11H2,1-2H3