3-bromanyl-5-methoxy-4-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)benzaldehyde

Systemtic Name: 3-bromanyl-5-methoxy-4-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)benzaldehyde Openeye Name: 3-bromo-5-methoxy-4-(2-oxo-2-thiomorpholino-ethoxy)benzaldehyde CAS Name: 3-bromo-5-methoxy-4-(2-oxo-2-thiomorpholin-4-ylethoxy)benzaldehyde IUPAC Name: 3-bromo-5-methoxy-4-(2-oxo-2-thiomorpholin-4-ylethoxy)benzaldehyde Traditional Name: 3-bromo-4-(2-keto-2-thiomorpholino-ethoxy)-5-methoxy-benzaldehyde Formula: C14H16BrNO4S MolecularWeight: 374.25014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OCC(=O)N2CCSCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OCC(=O)N2CCSCC2

InChI

InChI=1S/C14H16BrNO4S/c1-19-12-7-10(8-17)6-11(15)14(12)20-9-13(18)16-2-4-21-5-3-16/h6-8H,2-5,9H2,1H3