N-[(4-bromanyl-3-nitro-phenyl)methyl]oxan-4-amine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]oxan-4-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]tetrahydropyran-4-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-4-oxanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]oxan-4-amine Traditional Name: (4-bromo-3-nitro-benzyl)-tetrahydropyran-4-yl-amine Formula: C12H15BrN2O3 MolecularWeight: 315.1631

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCC1NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H15BrN2O3/c13-11-2-1-9(7-12(11)15(16)17)8-14-10-3-5-18-6-4-10/h1-2,7,10,14H,3-6,8H2