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

Systemtic Name: 4-methyl-N-(2-methylpentyl)-3-nitro-aniline Openeye Name: 4-methyl-N-(2-methylpentyl)-3-nitro-aniline CAS Name: 4-methyl-N-(2-methylpentyl)-3-nitroaniline IUPAC Name: 4-methyl-N-(2-methylpentyl)-3-nitroaniline Traditional Name: (4-methyl-3-nitro-phenyl)-(2-methylpentyl)amine Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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