(2-chloranylquinolin-3-yl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: (2-chloro-3-quinolyl)methyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid (2-chloro-3-quinolyl)methyl ester Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)OCC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)OCC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C21H17ClN2O3S/c22-21-15(11-14-5-1-2-6-16(14)23-21)12-27-20(26)9-10-24-17-7-3-4-8-18(17)28-13-19(24)25/h1-8,11H,9-10,12-13H2