3-(2-anthracen-9-ylsulfanylethyl)-4,4-dimethoxy-2-methyl-cyclobut-2-en-1-one

Systemtic Name: 3-(2-anthracen-9-ylsulfanylethyl)-4,4-dimethoxy-2-methyl-cyclobut-2-en-1-one Openeye Name: 3-[2-(9-anthrylsulfanyl)ethyl]-4,4-dimethoxy-2-methyl-cyclobut-2-en-1-one CAS Name: 3-[2-(9-anthracenylthio)ethyl]-4,4-dimethoxy-2-methyl-1-cyclobut-2-enone IUPAC Name: 3-(2-anthracen-9-ylsulfanylethyl)-4,4-dimethoxy-2-methylcyclobut-2-en-1-one Traditional Name: 3-[2-(9-anthrylthio)ethyl]-4,4-dimethoxy-2-methyl-cyclobut-2-en-1-one Formula: C23H22O3S MolecularWeight: 378.48398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C1=O)(OC)OC)CCSC2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CC1=C(C(C1=O)(OC)OC)CCSC2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C23H22O3S/c1-15-20(23(25-2,26-3)22(15)24)12-13-27-21-18-10-6-4-8-16(18)14-17-9-5-7-11-19(17)21/h4-11,14H,12-13H2,1-3H3