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

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 2-(1,1-dioxothiolan-3-yl)acetate CAS Name: 2-(1,1-dioxo-3-thiolanyl)acetic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 2-(1,1-dioxothiolan-3-yl)acetate Traditional Name: 2-(1,1-diketothiolan-3-yl)acetic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C18H19ClO6S MolecularWeight: 398.85786

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3CCS(=O)(=O)C3)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3CCS(=O)(=O)C3)Cl

InChI

InChI=1S/C18H19ClO6S/c1-2-12-6-16-14(8-15(12)19)13(7-18(21)25-16)9-24-17(20)5-11-3-4-26(22,23)10-11/h6-8,11H,2-5,9-10H2,1H3