3-[6-(4-oxidanylidene-1,3-benzothiazin-2-yl)pyridin-2-yl]propanoic acid

Systemtic Name: 3-[6-(4-oxidanylidene-1,3-benzothiazin-2-yl)pyridin-2-yl]propanoic acid Openeye Name: 3-[6-(4-oxo-1,3-benzothiazin-2-yl)-2-pyridyl]propanoic acid CAS Name: 3-[6-(4-oxo-1,3-benzothiazin-2-yl)-2-pyridinyl]propanoic acid IUPAC Name: 3-[6-(4-oxo-1,3-benzothiazin-2-yl)pyridin-2-yl]propanoic acid Traditional Name: 3-[6-(4-keto-1,3-benzothiazin-2-yl)-2-pyridyl]propionic acid Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(S2)C3=NC(=CC=C3)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(S2)C3=NC(=CC=C3)CCC(=O)O

InChI

InChI=1S/C16H12N2O3S/c19-14(20)9-8-10-4-3-6-12(17-10)16-18-15(21)11-5-1-2-7-13(11)22-16/h1-7H,8-9H2,(H,19,20)