O-[4-[6-methoxy-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-2-yl]phenyl] methanethioate

Systemtic Name: O-[4-[6-methoxy-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-2-yl]phenyl] methanethioate Openeye Name: O-[4-(5,7-dihydroxy-6-methoxy-4-oxo-chromen-2-yl)phenyl] methanethioate CAS Name: methanethioic acid O-[4-(5,7-dihydroxy-6-methoxy-4-oxo-1-benzopyran-2-yl)phenyl] ester IUPAC Name: O-[4-(5,7-dihydroxy-6-methoxy-4-oxochromen-2-yl)phenyl] methanethioate Traditional Name: methanethioic acid O-[4-(5,7-dihydroxy-4-keto-6-methoxy-chromen-2-yl)phenyl] ester Formula: C17H12O6S MolecularWeight: 344.33858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)OC=S)O

Isomeric SMILES

COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)OC=S)O

InChI

InChI=1S/C17H12O6S/c1-21-17-12(19)7-14-15(16(17)20)11(18)6-13(23-14)9-2-4-10(5-3-9)22-8-24/h2-8,19-20H,1H3