(5-bromanylpyridin-3-yl)-(3,4-dimethyl-5-nitro-phenyl)methanamine

Systemtic Name: (5-bromanylpyridin-3-yl)-(3,4-dimethyl-5-nitro-phenyl)methanamine Openeye Name: (5-bromo-3-pyridyl)-(3,4-dimethyl-5-nitro-phenyl)methanamine CAS Name: (5-bromo-3-pyridinyl)-(3,4-dimethyl-5-nitrophenyl)methanamine IUPAC Name: (5-bromopyridin-3-yl)-(3,4-dimethyl-5-nitrophenyl)methanamine Traditional Name: [(5-bromo-3-pyridyl)-(3,4-dimethyl-5-nitro-phenyl)methyl]amine Formula: C14H14BrN3O2 MolecularWeight: 336.18386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C2=CC(=CN=C2)Br)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C2=CC(=CN=C2)Br)N)[N+](=O)[O-])C

InChI

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