N-butylmethanamide; tris(bromanyl)methylsulfonylbenzene

Systemtic Name: N-butylmethanamide; tris(bromanyl)methylsulfonylbenzene Openeye Name: N-butylformamide; tribromomethylsulfonylbenzene CAS Name: N-butylformamide; tribromomethylsulfonylbenzene IUPAC Name: N-butylformamide; tribromomethylsulfonylbenzene Traditional Name: N-butylformamide; tribromomethylsulfonylbenzene Formula: C12H16Br3NO3S MolecularWeight: 494.03734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC=O.C1=CC=C(C=C1)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

CCCCNC=O.C1=CC=C(C=C1)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C7H5Br3O2S.C5H11NO/c8-7(9,10)13(11,12)6-4-2-1-3-5-6;1-2-3-4-6-5-7/h1-5H;5H,2-4H2,1H3,(H,6,7)