methyl 3-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-1,3-thiazinan-3-yl]propanoate

Systemtic Name: methyl 3-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-1,3-thiazinan-3-yl]propanoate Openeye Name: methyl 3-[2-(2-bromo-4,5-dimethoxy-phenyl)-4-oxo-1,3-thiazinan-3-yl]propanoate CAS Name: 3-[2-(2-bromo-4,5-dimethoxyphenyl)-4-oxo-1,3-thiazinan-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2-bromo-4,5-dimethoxyphenyl)-4-oxo-1,3-thiazinan-3-yl]propanoate Traditional Name: 3-[2-(2-bromo-4,5-dimethoxy-phenyl)-4-keto-1,3-thiazinan-3-yl]propionic acid methyl ester Formula: C16H20BrNO5S MolecularWeight: 418.3027

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2N(C(=O)CCS2)CCC(=O)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2N(C(=O)CCS2)CCC(=O)OC)Br)OC

InChI

InChI=1S/C16H20BrNO5S/c1-21-12-8-10(11(17)9-13(12)22-2)16-18(6-4-15(20)23-3)14(19)5-7-24-16/h8-9,16H,4-7H2,1-3H3