4-(4-acetyloxy-1,3-benzothiazol-2-yl)benzoic acid

Systemtic Name: 4-(4-acetyloxy-1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 4-(4-acetoxy-1,3-benzothiazol-2-yl)benzoic acid CAS Name: 4-(4-acetyloxy-1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 4-(4-acetyloxy-1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 4-(4-acetoxy-1,3-benzothiazol-2-yl)benzoic acid Formula: C16H11NO4S MolecularWeight: 313.32784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C(=CC=C1)SC(=N2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)OC1=C2C(=CC=C1)SC(=N2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H11NO4S/c1-9(18)21-12-3-2-4-13-14(12)17-15(22-13)10-5-7-11(8-6-10)16(19)20/h2-8H,1H3,(H,19,20)