(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CC3C(=O)NC4=CC=CC=C4S3)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CC3C(=O)NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H17ClN2O4S/c1-27-14-7-6-12-8-13(20(22)23-16(12)9-14)11-28-19(25)10-18-21(26)24-15-4-2-3-5-17(15)29-18/h2-9,18H,10-11H2,1H3,(H,24,26)