2-bromanyl-2-nitro-ethanoic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine

Systemtic Name: 2-bromanyl-2-nitro-ethanoic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine Openeye Name: 2-bromo-2-nitro-acetic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine CAS Name: 2-bromo-2-nitroacetic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine IUPAC Name: 2-bromo-2-nitroacetic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine Traditional Name: 2-bromo-2-nitro-acetic acid; 2-octyl-5,6-dihydro-4H-1,3-thiazine Formula: C14H25BrN2O4S MolecularWeight: 397.3283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NCCCS1.C(C(=O)O)([N+](=O)[O-])Br

Isomeric SMILES

CCCCCCCCC1=NCCCS1.C(C(=O)O)([N+](=O)[O-])Br

InChI

InChI=1S/C12H23NS.C2H2BrNO4/c1-2-3-4-5-6-7-9-12-13-10-8-11-14-12;3-1(2(5)6)4(7)8/h2-11H2,1H3;1H,(H,5,6)