1-(3,4-dimethyl-5-nitro-phenyl)-2-methyl-butan-1-amine

Systemtic Name: 1-(3,4-dimethyl-5-nitro-phenyl)-2-methyl-butan-1-amine Openeye Name: 1-(3,4-dimethyl-5-nitro-phenyl)-2-methyl-butan-1-amine CAS Name: 1-(3,4-dimethyl-5-nitrophenyl)-2-methyl-1-butanamine IUPAC Name: 1-(3,4-dimethyl-5-nitrophenyl)-2-methylbutan-1-amine Traditional Name: [1-(3,4-dimethyl-5-nitro-phenyl)-2-methyl-butyl]amine Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2/c1-5-8(2)13(14)11-6-9(3)10(4)12(7-11)15(16)17/h6-8,13H,5,14H2,1-4H3