N-[(3S,4R)-4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(3S,4R)-4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[(3S,4R)-4-chloro-1,1-dioxo-thiolan-3-yl]-3,4-dimethoxy-benzamide CAS Name: N-[(3S,4R)-4-chloro-1,1-dioxo-3-thiolanyl]-3,4-dimethoxybenzamide IUPAC Name: N-[(3S,4R)-4-chloro-1,1-dioxothiolan-3-yl]-3,4-dimethoxybenzamide Traditional Name: N-[(3S,4R)-4-chloro-1,1-diketo-thiolan-3-yl]-3,4-dimethoxy-benzamide Formula: C13H16ClNO5S MolecularWeight: 333.78784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CS(=O)(=O)CC2Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Cl)OC

InChI

InChI=1S/C13H16ClNO5S/c1-19-11-4-3-8(5-12(11)20-2)13(16)15-10-7-21(17,18)6-9(10)14/h3-5,9-10H,6-7H2,1-2H3,(H,15,16)/t9-,10-/m0/s1