(4E)-2,2-dimethyl-4-(oxidanylmethylidene)thian-3-one

Systemtic Name: (4E)-2,2-dimethyl-4-(oxidanylmethylidene)thian-3-one Openeye Name: (4E)-4-(hydroxymethylene)-2,2-dimethyl-tetrahydrothiopyran-3-one CAS Name: (4E)-4-(hydroxymethylidene)-2,2-dimethyl-3-thianone IUPAC Name: (4E)-4-(hydroxymethylidene)-2,2-dimethylthian-3-one Traditional Name: (4E)-4-(hydroxymethylene)-2,2-dimethyl-tetrahydrothiopyran-3-one Formula: C8H12O2S MolecularWeight: 172.24468

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=CO)CCS1)C

Isomeric SMILES

CC1(C(=O)/C(=C/O)/CCS1)C

InChI

InChI=1S/C8H12O2S/c1-8(2)7(10)6(5-9)3-4-11-8/h5,9H,3-4H2,1-2H3/b6-5+