[3-[tris(bromanyl)methylsulfonyl]phenyl] N-butylmethanimidate

Systemtic Name: [3-[tris(bromanyl)methylsulfonyl]phenyl] N-butylmethanimidate Openeye Name: [3-(tribromomethylsulfonyl)phenyl] N-butylmethanimidate CAS Name: N-butylmethanimidic acid [3-(tribromomethylsulfonyl)phenyl] ester IUPAC Name: [3-(tribromomethylsulfonyl)phenyl] N-butylmethanimidate Traditional Name: N-butylformimidic acid [3-(tribromomethylsulfonyl)phenyl] ester Formula: C12H14Br3NO3S MolecularWeight: 492.02146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=COC1=CC(=CC=C1)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

CCCCN=COC1=CC(=CC=C1)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C12H14Br3NO3S/c1-2-3-7-16-9-19-10-5-4-6-11(8-10)20(17,18)12(13,14)15/h4-6,8-9H,2-3,7H2,1H3