3,3,5-trimethyl-1,1-bis(oxidanylidene)-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol

Systemtic Name: 3,3,5-trimethyl-1,1-bis(oxidanylidene)-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Openeye Name: 3,3,5-trimethyl-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol CAS Name: 3,3,5-trimethyl-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol IUPAC Name: 3,3,5-trimethyl-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Traditional Name: 1,1-diketo-3,3,5-trimethyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CS(=O)(=O)C2=CC=CC=C12)(C)C)O

Isomeric SMILES

CC1C(C(CS(=O)(=O)C2=CC=CC=C12)(C)C)O

InChI

InChI=1S/C13H18O3S/c1-9-10-6-4-5-7-11(10)17(15,16)8-13(2,3)12(9)14/h4-7,9,12,14H,8H2,1-3H3