bromanylmethanamine; 1-nitro-4-(phenylsulfonyl)benzene

Systemtic Name: bromanylmethanamine; 1-nitro-4-(phenylsulfonyl)benzene Openeye Name: 1-(benzenesulfonyl)-4-nitro-benzene; bromomethanamine CAS Name: 1-(benzenesulfonyl)-4-nitrobenzene; bromomethanamine IUPAC Name: 1-(benzenesulfonyl)-4-nitrobenzene; bromomethanamine Traditional Name: 1-besyl-4-nitro-benzene; bromomethylamine Formula: C13H13BrN2O4S MolecularWeight: 373.22232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-].C(N)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-].C(N)Br

InChI

InChI=1S/C12H9NO4S.CH4BrN/c14-13(15)10-6-8-12(9-7-10)18(16,17)11-4-2-1-3-5-11;2-1-3/h1-9H;1,3H2