4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-6,7-dimethyl-chromen-2-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-6,7-dimethyl-chromen-2-one CAS Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-6,7-dimethylchromen-2-one Traditional Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-6,7-dimethyl-coumarin Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C20H18O4S/c1-12-7-16-14(9-20(21)24-18(16)8-13(12)2)11-25-15-3-4-17-19(10-15)23-6-5-22-17/h3-4,7-10H,5-6,11H2,1-2H3