(2-chloranylquinolin-3-yl)methyl 3-(1,3-thiazol-4-ylmethoxy)benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 3-(1,3-thiazol-4-ylmethoxy)benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 3-(thiazol-4-ylmethoxy)benzoate CAS Name: 3-(4-thiazolylmethoxy)benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 3-(1,3-thiazol-4-ylmethoxy)benzoate Traditional Name: 3-(thiazol-4-ylmethoxy)benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C21H15ClN2O3S MolecularWeight: 410.8734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=CC(=CC=C3)OCC4=CSC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=CC(=CC=C3)OCC4=CSC=N4

InChI

InChI=1S/C21H15ClN2O3S/c22-20-16(8-14-4-1-2-7-19(14)24-20)10-27-21(25)15-5-3-6-18(9-15)26-11-17-12-28-13-23-17/h1-9,12-13H,10-11H2