3-ethylsulfanyl-2-(4-hydroxyphenyl)-5-oxidanyl-inden-1-one

Systemtic Name: 3-ethylsulfanyl-2-(4-hydroxyphenyl)-5-oxidanyl-inden-1-one Openeye Name: 3-ethylsulfanyl-5-hydroxy-2-(4-hydroxyphenyl)inden-1-one CAS Name: 3-(ethylthio)-5-hydroxy-2-(4-hydroxyphenyl)-1-indenone IUPAC Name: 3-ethylsulfanyl-5-hydroxy-2-(4-hydroxyphenyl)inden-1-one Traditional Name: 3-(ethylthio)-5-hydroxy-2-(4-hydroxyphenyl)inden-1-one Formula: C17H14O3S MolecularWeight: 298.35626

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=O)C2=C1C=C(C=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CCSC1=C(C(=O)C2=C1C=C(C=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C17H14O3S/c1-2-21-17-14-9-12(19)7-8-13(14)16(20)15(17)10-3-5-11(18)6-4-10/h3-9,18-19H,2H2,1H3