4-methyl-N-(2-methylbutyl)-3-nitro-aniline

Systemtic Name: 4-methyl-N-(2-methylbutyl)-3-nitro-aniline Openeye Name: 4-methyl-N-(2-methylbutyl)-3-nitro-aniline CAS Name: 4-methyl-N-(2-methylbutyl)-3-nitroaniline IUPAC Name: 4-methyl-N-(2-methylbutyl)-3-nitroaniline Traditional Name: 2-methylbutyl-(4-methyl-3-nitro-phenyl)amine Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)CNC1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O2/c1-4-9(2)8-13-11-6-5-10(3)12(7-11)14(15)16/h5-7,9,13H,4,8H2,1-3H3