(3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)COCC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)COCC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H17ClN2O3S/c1-13-14-6-2-3-7-15(14)23-17(21(13)22)10-27-20(25)12-26-11-19-24-16-8-4-5-9-18(16)28-19/h2-9H,10-12H2,1H3