N-[[4-(2-methylpropoxy)-3-nitro-phenyl]methyl]ethanamine

Systemtic Name: N-[[4-(2-methylpropoxy)-3-nitro-phenyl]methyl]ethanamine Openeye Name: N-[(4-isobutoxy-3-nitro-phenyl)methyl]ethanamine CAS Name: N-[[4-(2-methylpropoxy)-3-nitrophenyl]methyl]ethanamine IUPAC Name: N-[[4-(2-methylpropoxy)-3-nitrophenyl]methyl]ethanamine Traditional Name: ethyl-(4-isobutoxy-3-nitro-benzyl)amine Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)OCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCNCC1=CC(=C(C=C1)OCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O3/c1-4-14-8-11-5-6-13(18-9-10(2)3)12(7-11)15(16)17/h5-7,10,14H,4,8-9H2,1-3H3