1-(4-bromanyl-3-nitro-phenyl)-N-(pyridin-2-ylmethyl)methanamine

Systemtic Name: 1-(4-bromanyl-3-nitro-phenyl)-N-(pyridin-2-ylmethyl)methanamine Openeye Name: 1-(4-bromo-3-nitro-phenyl)-N-(2-pyridylmethyl)methanamine CAS Name: 1-(4-bromo-3-nitrophenyl)-N-(2-pyridinylmethyl)methanamine IUPAC Name: 1-(4-bromo-3-nitrophenyl)-N-(pyridin-2-ylmethyl)methanamine Traditional Name: (4-bromo-3-nitro-benzyl)-(2-pyridylmethyl)amine Formula: C13H12BrN3O2 MolecularWeight: 322.15728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

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