N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-pyridin-4-yl-methanamine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-pyridin-4-yl-methanamine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-(4-pyridyl)methanamine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-pyridin-4-ylmethanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-pyridin-4-ylmethanamine Traditional Name: (4-bromo-3-nitro-benzyl)-(4-pyridylmethyl)amine Formula: C13H12BrN3O2 MolecularWeight: 322.15728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNCC2=CC=NC=C2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1CNCC2=CC=NC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H12BrN3O2/c14-12-2-1-11(7-13(12)17(18)19)9-16-8-10-3-5-15-6-4-10/h1-7,16H,8-9H2