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

Systemtic Name: N-[(2-butan-2-yloxy-5-nitro-phenyl)methyl]ethanamine Openeye Name: N-[(5-nitro-2-sec-butoxy-phenyl)methyl]ethanamine CAS Name: N-[(2-butan-2-yloxy-5-nitrophenyl)methyl]ethanamine IUPAC Name: N-[(2-butan-2-yloxy-5-nitrophenyl)methyl]ethanamine Traditional Name: ethyl-(5-nitro-2-sec-butoxy-benzyl)amine Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])CNCC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])CNCC

InChI

InChI=1S/C13H20N2O3/c1-4-10(3)18-13-7-6-12(15(16)17)8-11(13)9-14-5-2/h6-8,10,14H,4-5,9H2,1-3H3