6-chloranyl-7-methyl-4-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[[3-(trifluoromethyl)phenyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[3-(trifluoromethyl)phenyl]thio]methyl]coumarin Formula: C18H12ClF3O2S MolecularWeight: 384.79989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClF3O2S/c1-10-5-16-14(8-15(10)19)11(6-17(23)24-16)9-25-13-4-2-3-12(7-13)18(20,21)22/h2-8H,9H2,1H3