2-(6-chloranyl-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid

Systemtic Name: 2-(6-chloranyl-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 2-(6-chloro-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid CAS Name: 2-(6-chloro-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 2-(6-chloro-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 2-(6-chloro-4-phenyl-1,3-benzothiazol-2-yl)benzoic acid Formula: C20H12ClNO2S MolecularWeight: 365.83278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC3=C2N=C(S3)C4=CC=CC=C4C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC3=C2N=C(S3)C4=CC=CC=C4C(=O)O)Cl

InChI

InChI=1S/C20H12ClNO2S/c21-13-10-16(12-6-2-1-3-7-12)18-17(11-13)25-19(22-18)14-8-4-5-9-15(14)20(23)24/h1-11H,(H,23,24)