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

Systemtic Name: 6-chloranyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-methylchromen-2-one Traditional Name: 6-chloro-4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-7-methyl-coumarin Formula: C19H15ClO4S MolecularWeight: 374.838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C19H15ClO4S/c1-11-6-17-14(9-15(11)20)12(7-19(21)24-17)10-25-13-2-3-16-18(8-13)23-5-4-22-16/h2-3,6-9H,4-5,10H2,1H3