N-[(4-heptoxy-3-nitro-phenyl)methyl]ethanamine

Systemtic Name: N-[(4-heptoxy-3-nitro-phenyl)methyl]ethanamine Openeye Name: N-[(4-heptoxy-3-nitro-phenyl)methyl]ethanamine CAS Name: N-[(4-heptoxy-3-nitrophenyl)methyl]ethanamine IUPAC Name: N-[(4-heptoxy-3-nitrophenyl)methyl]ethanamine Traditional Name: ethyl-(4-heptoxy-3-nitro-benzyl)amine Formula: C16H26N2O3 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)CNCC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)CNCC)[N+](=O)[O-]

InChI

InChI=1S/C16H26N2O3/c1-3-5-6-7-8-11-21-16-10-9-14(13-17-4-2)12-15(16)18(19)20/h9-10,12,17H,3-8,11,13H2,1-2H3