N-[[2-(2-methylpropoxy)-5-nitro-phenyl]methyl]propan-1-amine

Systemtic Name: N-[[2-(2-methylpropoxy)-5-nitro-phenyl]methyl]propan-1-amine Openeye Name: N-[(2-isobutoxy-5-nitro-phenyl)methyl]propan-1-amine CAS Name: N-[[2-(2-methylpropoxy)-5-nitrophenyl]methyl]-1-propanamine IUPAC Name: N-[[2-(2-methylpropoxy)-5-nitrophenyl]methyl]propan-1-amine Traditional Name: (2-isobutoxy-5-nitro-benzyl)-propyl-amine Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(C)C

Isomeric SMILES

CCCNCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(C)C

InChI

InChI=1S/C14H22N2O3/c1-4-7-15-9-12-8-13(16(17)18)5-6-14(12)19-10-11(2)3/h5-6,8,11,15H,4,7,9-10H2,1-3H3