5-(3-oxidanylidene-1,4-benzothiazin-4-yl)pentylboronic acid

Systemtic Name: 5-(3-oxidanylidene-1,4-benzothiazin-4-yl)pentylboronic acid Openeye Name: 5-(3-oxo-1,4-benzothiazin-4-yl)pentylboronic acid CAS Name: 5-(3-oxo-1,4-benzothiazin-4-yl)pentylboronic acid IUPAC Name: 5-(3-oxo-1,4-benzothiazin-4-yl)pentylboronic acid Traditional Name: 5-(3-keto-1,4-benzothiazin-4-yl)pentylboronic acid Formula: C13H18BNO3S MolecularWeight: 279.16292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(CCCCCN1C(=O)CSC2=CC=CC=C21)(O)O

Isomeric SMILES

B(CCCCCN1C(=O)CSC2=CC=CC=C21)(O)O

InChI

InChI=1S/C13H18BNO3S/c16-13-10-19-12-7-3-2-6-11(12)15(13)9-5-1-4-8-14(17)18/h2-3,6-7,17-18H,1,4-5,8-10H2