S-[[2,6-bis(oxidanylidene)cyclohexyl]methyl] ethanethioate

Systemtic Name: S-[[2,6-bis(oxidanylidene)cyclohexyl]methyl] ethanethioate Openeye Name: S-[(2,6-dioxocyclohexyl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(2,6-dioxocyclohexyl)methyl] ester IUPAC Name: S-[(2,6-dioxocyclohexyl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(2,6-diketocyclohexyl)methyl] ester Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1C(=O)CCCC1=O

Isomeric SMILES

CC(=O)SCC1C(=O)CCCC1=O

InChI

InChI=1S/C9H12O3S/c1-6(10)13-5-7-8(11)3-2-4-9(7)12/h7H,2-5H2,1H3