N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-methyl-butan-1-amine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-methyl-butan-1-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-3-methyl-butan-1-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-methyl-1-butanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-methylbutan-1-amine Traditional Name: (4-bromo-3-nitro-benzyl)-isoamyl-amine Formula: C12H17BrN2O2 MolecularWeight: 301.17958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H17BrN2O2/c1-9(2)5-6-14-8-10-3-4-11(13)12(7-10)15(16)17/h3-4,7,9,14H,5-6,8H2,1-2H3