methyl 3-oxidanylidene-3-[3-oxidanyl-4-(phenylmethyl)-1,4-benzothiazin-2-yl]propanoate

Systemtic Name: methyl 3-oxidanylidene-3-[3-oxidanyl-4-(phenylmethyl)-1,4-benzothiazin-2-yl]propanoate Openeye Name: methyl 3-(4-benzyl-3-hydroxy-1,4-benzothiazin-2-yl)-3-oxo-propanoate CAS Name: 3-[3-hydroxy-4-(phenylmethyl)-1,4-benzothiazin-2-yl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(4-benzyl-3-hydroxy-1,4-benzothiazin-2-yl)-3-oxopropanoate Traditional Name: 3-(4-benzyl-3-hydroxy-1,4-benzothiazin-2-yl)-3-keto-propionic acid methyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=C(N(C2=CC=CC=C2S1)CC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)CC(=O)C1=C(N(C2=CC=CC=C2S1)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H17NO4S/c1-24-17(22)11-15(21)18-19(23)20(12-13-7-3-2-4-8-13)14-9-5-6-10-16(14)25-18/h2-10,23H,11-12H2,1H3