N-hexan-2-yl-3-nitro-aniline

Systemtic Name: N-hexan-2-yl-3-nitro-aniline Openeye Name: N-(1-methylpentyl)-3-nitro-aniline CAS Name: N-hexan-2-yl-3-nitroaniline IUPAC Name: N-hexan-2-yl-3-nitroaniline Traditional Name: 1-methylpentyl-(3-nitrophenyl)amine Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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