2-[(5-chloranyl-1,3-benzothiazol-2-yl)methyl]benzoic acid

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)methyl]benzoic acid Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)methyl]benzoic acid CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)methyl]benzoic acid IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)methyl]benzoic acid Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)methyl]benzoic acid Formula: C15H10ClNO2S MolecularWeight: 303.7634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NC3=C(S2)C=CC(=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NC3=C(S2)C=CC(=C3)Cl)C(=O)O

InChI

InChI=1S/C15H10ClNO2S/c16-10-5-6-13-12(8-10)17-14(20-13)7-9-3-1-2-4-11(9)15(18)19/h1-6,8H,7H2,(H,18,19)