1-chloranyl-4-octoxy-thioxanthen-9-one

Systemtic Name: 1-chloranyl-4-octoxy-thioxanthen-9-one Openeye Name: 1-chloro-4-octoxy-thioxanthen-9-one CAS Name: 1-chloro-4-octoxy-9-thioxanthenone IUPAC Name: 1-chloro-4-octoxythioxanthen-9-one Traditional Name: 1-chloro-4-octoxy-thioxanthen-9-one Formula: C21H23ClO2S MolecularWeight: 374.92412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C2C(=C(C=C1)Cl)C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CCCCCCCCOC1=C2C(=C(C=C1)Cl)C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C21H23ClO2S/c1-2-3-4-5-6-9-14-24-17-13-12-16(22)19-20(23)15-10-7-8-11-18(15)25-21(17)19/h7-8,10-13H,2-6,9,14H2,1H3