(5-bromanylpyridin-3-yl)-(2-ethyl-5-nitro-phenyl)methanamine

Systemtic Name: (5-bromanylpyridin-3-yl)-(2-ethyl-5-nitro-phenyl)methanamine Openeye Name: (5-bromo-3-pyridyl)-(2-ethyl-5-nitro-phenyl)methanamine CAS Name: (5-bromo-3-pyridinyl)-(2-ethyl-5-nitrophenyl)methanamine IUPAC Name: (5-bromopyridin-3-yl)-(2-ethyl-5-nitrophenyl)methanamine Traditional Name: [(5-bromo-3-pyridyl)-(2-ethyl-5-nitro-phenyl)methyl]amine Formula: C14H14BrN3O2 MolecularWeight: 336.18386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CN=C2)Br)N

Isomeric SMILES

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CN=C2)Br)N

InChI

InChI=1S/C14H14BrN3O2/c1-2-9-3-4-12(18(19)20)6-13(9)14(16)10-5-11(15)8-17-7-10/h3-8,14H,2,16H2,1H3