2-methylsulfanyl-5-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-methylsulfanyl-5-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one Openeye Name: 2-methylsulfanyl-5-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one CAS Name: 2-(methylthio)-5-(2,3,4-trimethoxyphenyl)-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-methylsulfanyl-5-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one Traditional Name: 2-(methylthio)-5-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CC=C(C(=O)C=C2)SC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CC=C(C(=O)C=C2)SC)OC)OC

InChI

InChI=1S/C17H18O4S/c1-19-14-9-7-12(16(20-2)17(14)21-3)11-5-8-13(18)15(22-4)10-6-11/h5-10H,1-4H3