N-[(2-methoxy-5-nitro-phenyl)methyl]-2-methyl-propan-1-amine

Systemtic Name: N-[(2-methoxy-5-nitro-phenyl)methyl]-2-methyl-propan-1-amine Openeye Name: N-[(2-methoxy-5-nitro-phenyl)methyl]-2-methyl-propan-1-amine CAS Name: N-[(2-methoxy-5-nitrophenyl)methyl]-2-methyl-1-propanamine IUPAC Name: N-[(2-methoxy-5-nitrophenyl)methyl]-2-methylpropan-1-amine Traditional Name: isobutyl-(2-methoxy-5-nitro-benzyl)amine Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CNCC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

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