N-[(4-hexoxy-3-nitro-phenyl)methyl]propan-1-amine

Systemtic Name: N-[(4-hexoxy-3-nitro-phenyl)methyl]propan-1-amine Openeye Name: N-[(4-hexoxy-3-nitro-phenyl)methyl]propan-1-amine CAS Name: N-[(4-hexoxy-3-nitrophenyl)methyl]-1-propanamine IUPAC Name: N-[(4-hexoxy-3-nitrophenyl)methyl]propan-1-amine Traditional Name: (4-hexoxy-3-nitro-benzyl)-propyl-amine Formula: C16H26N2O3 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CNCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CNCCC)[N+](=O)[O-]

InChI

InChI=1S/C16H26N2O3/c1-3-5-6-7-11-21-16-9-8-14(13-17-10-4-2)12-15(16)18(19)20/h8-9,12,17H,3-7,10-11,13H2,1-2H3