N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanamide Openeye Name: 2-(4-bromo-5-formyl-2-methoxy-phenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-(4-bromo-5-formyl-2-methoxyphenoxy)-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(4-bromo-5-formyl-2-methoxyphenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-(4-bromo-5-formyl-2-methoxy-phenoxy)-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C14H16BrNO6S MolecularWeight: 406.24894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=O)OCC(=O)NC2CCS(=O)(=O)C2

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)C=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C14H16BrNO6S/c1-21-12-5-11(15)9(6-17)4-13(12)22-7-14(18)16-10-2-3-23(19,20)8-10/h4-6,10H,2-3,7-8H2,1H3,(H,16,18)/t10-/m0/s1