N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(7-methoxy-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxy-N-methyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(7-methoxy-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxy-N-methyl-ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(1-hydroxy-7-methoxy-9-oxo-xanthen-3-yl)oxy-N-methyl-acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[(1-hydroxy-7-methoxy-9-oxo-3-xanthenyl)oxy]-N-methylacetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(1-hydroxy-7-methoxy-9-oxoxanthen-3-yl)oxy-N-methylacetamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-(1-hydroxy-9-keto-7-methoxy-xanthen-3-yl)oxy-N-methyl-acetamide Formula: C21H21NO8S MolecularWeight: 447.45834

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)COC2=CC(=C3C(=C2)OC4=C(C3=O)C=C(C=C4)OC)O

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)COC2=CC(=C3C(=C2)OC4=C(C3=O)C=C(C=C4)OC)O

InChI

InChI=1S/C21H21NO8S/c1-22(12-5-6-31(26,27)11-12)19(24)10-29-14-8-16(23)20-18(9-14)30-17-4-3-13(28-2)7-15(17)21(20)25/h3-4,7-9,12,23H,5-6,10-11H2,1-2H3/t12-/m0/s1