4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one

Systemtic Name: 4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one Openeye Name: 4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one CAS Name: 4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one IUPAC Name: 4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one Traditional Name: 4,4-dimethyl-1,5-dihydro-3-benzothiepin-2-one Formula: C12H14OS MolecularWeight: 206.30396

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2CC(=O)S1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2CC(=O)S1)C

InChI

InChI=1S/C12H14OS/c1-12(2)8-10-6-4-3-5-9(10)7-11(13)14-12/h3-6H,7-8H2,1-2H3