N,N-dimethyl-4-[1,1,1-tris(bromanyl)-3-nitro-propan-2-yl]aniline

Systemtic Name: N,N-dimethyl-4-[1,1,1-tris(bromanyl)-3-nitro-propan-2-yl]aniline Openeye Name: N,N-dimethyl-4-[2,2,2-tribromo-1-(nitromethyl)ethyl]aniline CAS Name: N,N-dimethyl-4-(1,1,1-tribromo-3-nitropropan-2-yl)aniline IUPAC Name: N,N-dimethyl-4-(1,1,1-tribromo-3-nitropropan-2-yl)aniline Traditional Name: dimethyl-[4-[2,2,2-tribromo-1-(nitromethyl)ethyl]phenyl]amine Formula: C11H13Br3N2O2 MolecularWeight: 444.94512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13Br3N2O2/c1-15(2)9-5-3-8(4-6-9)10(7-16(17)18)11(12,13)14/h3-6,10H,7H2,1-2H3