4-bromanyl-N-hexan-2-yl-2-nitro-aniline

Systemtic Name: 4-bromanyl-N-hexan-2-yl-2-nitro-aniline Openeye Name: 4-bromo-N-(1-methylpentyl)-2-nitro-aniline CAS Name: 4-bromo-N-hexan-2-yl-2-nitroaniline IUPAC Name: 4-bromo-N-hexan-2-yl-2-nitroaniline Traditional Name: (4-bromo-2-nitro-phenyl)-(1-methylpentyl)amine Formula: C12H17BrN2O2 MolecularWeight: 301.17958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrN2O2/c1-3-4-5-9(2)14-11-7-6-10(13)8-12(11)15(16)17/h6-9,14H,3-5H2,1-2H3