4-[4-(3-oxidanylidene-1,2-benzothiazol-2-yl)phenoxy]butanoic acid

Systemtic Name: 4-[4-(3-oxidanylidene-1,2-benzothiazol-2-yl)phenoxy]butanoic acid Openeye Name: 4-[4-(3-oxo-1,2-benzothiazol-2-yl)phenoxy]butanoic acid CAS Name: 4-[4-(3-oxo-1,2-benzothiazol-2-yl)phenoxy]butanoic acid IUPAC Name: 4-[4-(3-oxo-1,2-benzothiazol-2-yl)phenoxy]butanoic acid Traditional Name: 4-[4-(3-keto-1,2-benzothiazol-2-yl)phenoxy]butyric acid Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)OCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)OCCCC(=O)O

InChI

InChI=1S/C17H15NO4S/c19-16(20)6-3-11-22-13-9-7-12(8-10-13)18-17(21)14-4-1-2-5-15(14)23-18/h1-2,4-5,7-10H,3,6,11H2,(H,19,20)