N-hexan-2-yl-2-methyl-5-nitro-aniline

Systemtic Name: N-hexan-2-yl-2-methyl-5-nitro-aniline Openeye Name: 2-methyl-N-(1-methylpentyl)-5-nitro-aniline CAS Name: N-hexan-2-yl-2-methyl-5-nitroaniline IUPAC Name: N-hexan-2-yl-2-methyl-5-nitroaniline Traditional Name: (2-methyl-5-nitro-phenyl)-(1-methylpentyl)amine Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCCC(C)NC1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N2O2/c1-4-5-6-11(3)14-13-9-12(15(16)17)8-7-10(13)2/h7-9,11,14H,4-6H2,1-3H3