(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(1,1-dioxothiolan-3-yl)acetate CAS Name: 2-(1,1-dioxo-3-thiolanyl)acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(1,1-dioxothiolan-3-yl)acetate Traditional Name: 2-(1,1-diketothiolan-3-yl)acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C18H19NO7S MolecularWeight: 393.41096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC3CCS(=O)(=O)C3

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CC3CCS(=O)(=O)C3

InChI

InChI=1S/C18H19NO7S/c1-11(20)19-14-2-3-15-13(7-18(22)26-16(15)8-14)9-25-17(21)6-12-4-5-27(23,24)10-12/h2-3,7-8,12H,4-6,9-10H2,1H3,(H,19,20)