3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid

Systemtic Name: 3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid Openeye Name: 3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid CAS Name: 3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxypropanoic acid IUPAC Name: 3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxypropanoic acid Traditional Name: 3-[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]-2-phenoxy-propionic acid Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2N1CCOC3=CC=C(C=C3)CC(C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1CSC2=CC=CC=C2N1CCOC3=CC=C(C=C3)CC(C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C25H25NO4S/c27-25(28)23(30-21-6-2-1-3-7-21)18-19-10-12-20(13-11-19)29-16-14-26-15-17-31-24-9-5-4-8-22(24)26/h1-13,23H,14-18H2,(H,27,28)