5-[2-(2-ethoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]pentylboronic acid

Systemtic Name: 5-[2-(2-ethoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]pentylboronic acid Openeye Name: 5-[2-(2-ethoxy-2-oxo-ethyl)-3-oxo-1,4-benzothiazin-4-yl]pentylboronic acid CAS Name: 5-[2-(2-ethoxy-2-oxoethyl)-3-oxo-1,4-benzothiazin-4-yl]pentylboronic acid IUPAC Name: 5-[2-(2-ethoxy-2-oxoethyl)-3-oxo-1,4-benzothiazin-4-yl]pentylboronic acid Traditional Name: 5-[2-(2-ethoxy-2-keto-ethyl)-3-keto-1,4-benzothiazin-4-yl]pentylboronic acid Formula: C17H24BNO5S MolecularWeight: 365.25216

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Descriptors Computed from Structure

Canonical SMILES:

B(CCCCCN1C2=CC=CC=C2SC(C1=O)CC(=O)OCC)(O)O

Isomeric SMILES

B(CCCCCN1C2=CC=CC=C2SC(C1=O)CC(=O)OCC)(O)O

InChI

InChI=1S/C17H24BNO5S/c1-2-24-16(20)12-15-17(21)19(11-7-3-6-10-18(22)23)13-8-4-5-9-14(13)25-15/h4-5,8-9,15,22-23H,2-3,6-7,10-12H2,1H3