methyl 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]propanoate

Systemtic Name: methyl 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]propanoate Openeye Name: methyl 2-[4-[(2-chloro-4-fluoro-phenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoate CAS Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanoate Traditional Name: 2-[4-(2-chloro-4-fluoro-benzyl)-3-keto-1,4-benzothiazin-2-yl]propionic acid methyl ester Formula: C19H17ClFNO3S MolecularWeight: 393.859583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)N(C2=CC=CC=C2S1)CC3=C(C=C(C=C3)F)Cl)C(=O)OC

Isomeric SMILES

CC(C1C(=O)N(C2=CC=CC=C2S1)CC3=C(C=C(C=C3)F)Cl)C(=O)OC

InChI

InChI=1S/C19H17ClFNO3S/c1-11(19(24)25-2)17-18(23)22(15-5-3-4-6-16(15)26-17)10-12-7-8-13(21)9-14(12)20/h3-9,11,17H,10H2,1-2H3