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

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-pyridin-3-yl-ethanamine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-(3-pyridyl)ethanamine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-(3-pyridinyl)ethanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-pyridin-3-ylethanamine Traditional Name: (4-bromo-3-nitro-benzyl)-[1-(3-pyridyl)ethyl]amine Formula: C14H14BrN3O2 MolecularWeight: 336.18386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CN=CC=C1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H14BrN3O2/c1-10(12-3-2-6-16-9-12)17-8-11-4-5-13(15)14(7-11)18(19)20/h2-7,9-10,17H,8H2,1H3