2-(2-ethylhexoxy)-1-methyl-thioxanthen-9-one

Systemtic Name: 2-(2-ethylhexoxy)-1-methyl-thioxanthen-9-one Openeye Name: 2-(2-ethylhexoxy)-1-methyl-thioxanthen-9-one CAS Name: 2-(2-ethylhexoxy)-1-methyl-9-thioxanthenone IUPAC Name: 2-(2-ethylhexoxy)-1-methylthioxanthen-9-one Traditional Name: 2-(2-ethylhexoxy)-1-methyl-thioxanthen-9-one Formula: C22H26O2S MolecularWeight: 354.50564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C2=C(C=C1)SC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCCCC(CC)COC1=C(C2=C(C=C1)SC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C22H26O2S/c1-4-6-9-16(5-2)14-24-18-12-13-20-21(15(18)3)22(23)17-10-7-8-11-19(17)25-20/h7-8,10-13,16H,4-6,9,14H2,1-3H3