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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H17BrN2O2/c1-3-10(4-2)14-8-9-5-6-11(13)12(7-9)15(16)17/h5-7,10,14H,3-4,8H2,1-2H3