methyl 4-(5-chloranyl-1,3-benzothiazol-2-yl)benzoate

Systemtic Name: methyl 4-(5-chloranyl-1,3-benzothiazol-2-yl)benzoate Openeye Name: methyl 4-(5-chloro-1,3-benzothiazol-2-yl)benzoate CAS Name: 4-(5-chloro-1,3-benzothiazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-chloro-1,3-benzothiazol-2-yl)benzoate Traditional Name: 4-(5-chloro-1,3-benzothiazol-2-yl)benzoic acid methyl ester Formula: C15H10ClNO2S MolecularWeight: 303.7634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C15H10ClNO2S/c1-19-15(18)10-4-2-9(3-5-10)14-17-12-8-11(16)6-7-13(12)20-14/h2-8H,1H3