4-(2-hydroxyethylsulfanylmethyl)-7-oxidanyl-chromen-2-one

Systemtic Name: 4-(2-hydroxyethylsulfanylmethyl)-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-(2-hydroxyethylsulfanylmethyl)chromen-2-one CAS Name: 7-hydroxy-4-[(2-hydroxyethylthio)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-(2-hydroxyethylsulfanylmethyl)chromen-2-one Traditional Name: 7-hydroxy-4-[(2-hydroxyethylthio)methyl]coumarin Formula: C12H12O4S MolecularWeight: 252.28628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC(=O)C=C2CSCCO

Isomeric SMILES

C1=CC2=C(C=C1O)OC(=O)C=C2CSCCO

InChI

InChI=1S/C12H12O4S/c13-3-4-17-7-8-5-12(15)16-11-6-9(14)1-2-10(8)11/h1-2,5-6,13-14H,3-4,7H2