3-azido-8-bromanyl-2,4-diethanoyl-2,4,5,6-tetrakis(oxidanyl)-7-oxidanylidene-octanal

Systemtic Name: 3-azido-8-bromanyl-2,4-diethanoyl-2,4,5,6-tetrakis(oxidanyl)-7-oxidanylidene-octanal Openeye Name: 2,4-diacetyl-3-azido-8-bromo-2,4,5,6-tetrahydroxy-7-oxo-octanal CAS Name: 2,4-diacetyl-3-azido-8-bromo-2,4,5,6-tetrahydroxy-7-oxooctanal IUPAC Name: 2,4-diacetyl-3-azido-8-bromo-2,4,5,6-tetrahydroxy-7-oxooctanal Traditional Name: 2,4-diacetyl-3-azido-8-bromo-2,4,5,6-tetrahydroxy-7-keto-caprylaldehyde Formula: C12H16BrN3O8 MolecularWeight: 410.17474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C=O)(C(C(C(C(C(=O)CBr)O)O)(C(=O)C)O)N=[N+]=[N-])O

Isomeric SMILES

CC(=O)C(C=O)(C(C(C(C(C(=O)CBr)O)O)(C(=O)C)O)N=[N+]=[N-])O

InChI

InChI=1S/C12H16BrN3O8/c1-5(18)11(23,4-17)10(15-16-14)12(24,6(2)19)9(22)8(21)7(20)3-13/h4,8-10,21-24H,3H2,1-2H3