(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoate CAS Name: 2-(2-oxolanylmethylthio)benzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(tetrahydrofurfurylthio)benzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C23H22O6S MolecularWeight: 426.48218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3SCC4CCCO4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3SCC4CCCO4

InChI

InChI=1S/C23H22O6S/c1-26-16-8-9-18-15(11-22(24)29-20(18)12-16)13-28-23(25)19-6-2-3-7-21(19)30-14-17-5-4-10-27-17/h2-3,6-9,11-12,17H,4-5,10,13-14H2,1H3