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

Systemtic Name: N-methyl-1-[2-(2-methylpropoxy)-5-nitro-phenyl]methanamine Openeye Name: 1-(2-isobutoxy-5-nitro-phenyl)-N-methyl-methanamine CAS Name: N-methyl-1-[2-(2-methylpropoxy)-5-nitrophenyl]methanamine IUPAC Name: N-methyl-1-[2-(2-methylpropoxy)-5-nitrophenyl]methanamine Traditional Name: (2-isobutoxy-5-nitro-benzyl)-methyl-amine Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)[N+](=O)[O-])CNC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)[N+](=O)[O-])CNC

InChI

InChI=1S/C12H18N2O3/c1-9(2)8-17-12-5-4-11(14(15)16)6-10(12)7-13-3/h4-6,9,13H,7-8H2,1-3H3