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

Systemtic Name: N-[(3-nitro-4-propan-2-yloxy-phenyl)methyl]ethanamine Openeye Name: N-[(4-isopropoxy-3-nitro-phenyl)methyl]ethanamine CAS Name: N-[(3-nitro-4-propan-2-yloxyphenyl)methyl]ethanamine IUPAC Name: N-[(3-nitro-4-propan-2-yloxyphenyl)methyl]ethanamine Traditional Name: ethyl-(4-isopropoxy-3-nitro-benzyl)amine Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3/c1-4-13-8-10-5-6-12(17-9(2)3)11(7-10)14(15)16/h5-7,9,13H,4,8H2,1-3H3