8-methyl-4-[(4-methylphenyl)sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 8-methyl-4-[(4-methylphenyl)sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-8-methyl-4-(p-tolylsulfanylmethyl)chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[(4-methylphenyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[(4-methylphenyl)sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[(p-tolylthio)methyl]coumarin Formula: C18H16O3S MolecularWeight: 312.38284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)OC3=C2C=CC(=C3C)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)OC3=C2C=CC(=C3C)O

InChI

InChI=1S/C18H16O3S/c1-11-3-5-14(6-4-11)22-10-13-9-17(20)21-18-12(2)16(19)8-7-15(13)18/h3-9,19H,10H2,1-2H3