7-tert-butyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one

Systemtic Name: 7-tert-butyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one Openeye Name: 7-tert-butyl-1,1-dioxo-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one CAS Name: 7-tert-butyl-1,1-dioxo-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one IUPAC Name: 7-tert-butyl-1,1-dioxo-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one Traditional Name: 7-tert-butyl-1,1-diketo-3,4-dihydro-2H-1$l^{6}-benzothiepin-5-one Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)S(=O)(=O)CCCC2=O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)S(=O)(=O)CCCC2=O

InChI

InChI=1S/C14H18O3S/c1-14(2,3)10-6-7-13-11(9-10)12(15)5-4-8-18(13,16)17/h6-7,9H,4-5,8H2,1-3H3