2-[4-(1,3-benzothiazol-2-yl)-2-oxidanyl-phenoxy]propanoic acid

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)-2-oxidanyl-phenoxy]propanoic acid Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)-2-hydroxy-phenoxy]propanoic acid CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-2-hydroxyphenoxy]propanoic acid IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)-2-hydroxyphenoxy]propanoic acid Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)-2-hydroxy-phenoxy]propionic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)O

Isomeric SMILES

CC(C(=O)O)OC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C16H13NO4S/c1-9(16(19)20)21-13-7-6-10(8-12(13)18)15-17-11-4-2-3-5-14(11)22-15/h2-9,18H,1H3,(H,19,20)