methyl 11-(1,3-benzothiazol-2-ylsulfonyl)-10-oxidanyl-undecanoate

Systemtic Name: methyl 11-(1,3-benzothiazol-2-ylsulfonyl)-10-oxidanyl-undecanoate Openeye Name: methyl 11-(1,3-benzothiazol-2-ylsulfonyl)-10-hydroxy-undecanoate CAS Name: 11-(1,3-benzothiazol-2-ylsulfonyl)-10-hydroxyundecanoic acid methyl ester IUPAC Name: methyl 11-(1,3-benzothiazol-2-ylsulfonyl)-10-hydroxyundecanoate Traditional Name: 11-(1,3-benzothiazol-2-ylsulfonyl)-10-hydroxy-undecanoic acid methyl ester Formula: C19H27NO5S2 MolecularWeight: 413.55138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCC(CS(=O)(=O)C1=NC2=CC=CC=C2S1)O

Isomeric SMILES

COC(=O)CCCCCCCCC(CS(=O)(=O)C1=NC2=CC=CC=C2S1)O

InChI

InChI=1S/C19H27NO5S2/c1-25-18(22)13-7-5-3-2-4-6-10-15(21)14-27(23,24)19-20-16-11-8-9-12-17(16)26-19/h8-9,11-12,15,21H,2-7,10,13-14H2,1H3