sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide

Systemtic Name: sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide Openeye Name: sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide CAS Name: sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide IUPAC Name: sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide Traditional Name: sodium 17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene bromide Formula: C16H24BrNaO7 MolecularWeight: 431.25133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)OCCOCCOCCOCCO2)OC.[Na+].[Br-]

Isomeric SMILES

COC1=C(C=C2C(=C1)OCCOCCOCCOCCO2)OC.[Na+].[Br-]

InChI

InChI=1S/C16H24O7.BrH.Na/c1-17-13-11-15-16(12-14(13)18-2)23-10-8-21-6-4-19-3-5-20-7-9-22-15;;/h11-12H,3-10H2,1-2H3;1H;/q;;+1/p-1