6-chloranyl-4-methyl-7-[(4-methylsulfanylphenyl)methoxy]chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[(4-methylsulfanylphenyl)methoxy]chromen-2-one Openeye Name: 6-chloro-4-methyl-7-[(4-methylsulfanylphenyl)methoxy]chromen-2-one CAS Name: 6-chloro-4-methyl-7-[[4-(methylthio)phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-[(4-methylsulfanylphenyl)methoxy]chromen-2-one Traditional Name: 6-chloro-4-methyl-7-[4-(methylthio)benzyl]oxy-coumarin Formula: C18H15ClO3S MolecularWeight: 346.8279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C18H15ClO3S/c1-11-7-18(20)22-16-9-17(15(19)8-14(11)16)21-10-12-3-5-13(23-2)6-4-12/h3-9H,10H2,1-2H3