1-(3-methyl-5-nitro-phenyl)butan-1-amine

Systemtic Name: 1-(3-methyl-5-nitro-phenyl)butan-1-amine Openeye Name: 1-(3-methyl-5-nitro-phenyl)butan-1-amine CAS Name: 1-(3-methyl-5-nitrophenyl)-1-butanamine IUPAC Name: 1-(3-methyl-5-nitrophenyl)butan-1-amine Traditional Name: 1-(3-methyl-5-nitro-phenyl)butylamine Formula: C11H16N2O2 MolecularWeight: 208.25694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O2/c1-3-4-11(12)9-5-8(2)6-10(7-9)13(14)15/h5-7,11H,3-4,12H2,1-2H3