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

Systemtic Name: 4-bromanyl-2-nitro-N-octan-2-yl-aniline Openeye Name: 4-bromo-N-(1-methylheptyl)-2-nitro-aniline CAS Name: 4-bromo-2-nitro-N-octan-2-ylaniline IUPAC Name: 4-bromo-2-nitro-N-octan-2-ylaniline Traditional Name: (4-bromo-2-nitro-phenyl)-(1-methylheptyl)amine Formula: C14H21BrN2O2 MolecularWeight: 329.23274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21BrN2O2/c1-3-4-5-6-7-11(2)16-13-9-8-12(15)10-14(13)17(18)19/h8-11,16H,3-7H2,1-2H3