1-methoxy-4-[1,1,1-tris(bromanyl)-3-nitro-propan-2-yl]benzene

Systemtic Name: 1-methoxy-4-[1,1,1-tris(bromanyl)-3-nitro-propan-2-yl]benzene Openeye Name: 1-methoxy-4-[2,2,2-tribromo-1-(nitromethyl)ethyl]benzene CAS Name: 1-methoxy-4-(1,1,1-tribromo-3-nitropropan-2-yl)benzene IUPAC Name: 1-methoxy-4-(1,1,1-tribromo-3-nitropropan-2-yl)benzene Traditional Name: 1-methoxy-4-[2,2,2-tribromo-1-(nitromethyl)ethyl]benzene Formula: C10H10Br3NO3 MolecularWeight: 431.9033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[N+](=O)[O-])C(Br)(Br)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(C[N+](=O)[O-])C(Br)(Br)Br

InChI

InChI=1S/C10H10Br3NO3/c1-17-8-4-2-7(3-5-8)9(6-14(15)16)10(11,12)13/h2-5,9H,6H2,1H3