N-[(3-nitro-4-pentoxy-phenyl)methyl]propan-2-amine

Systemtic Name: N-[(3-nitro-4-pentoxy-phenyl)methyl]propan-2-amine Openeye Name: N-[(3-nitro-4-pentoxy-phenyl)methyl]propan-2-amine CAS Name: N-[(3-nitro-4-pentoxyphenyl)methyl]-2-propanamine IUPAC Name: N-[(3-nitro-4-pentoxyphenyl)methyl]propan-2-amine Traditional Name: (4-amoxy-3-nitro-benzyl)-isopropyl-amine Formula: C15H24N2O3 MolecularWeight: 280.36266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O3/c1-4-5-6-9-20-15-8-7-13(11-16-12(2)3)10-14(15)17(18)19/h7-8,10,12,16H,4-6,9,11H2,1-3H3