1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanone

Systemtic Name: 1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanone Openeye Name: 1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanone CAS Name: 1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)ethanone IUPAC Name: 1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanone Traditional Name: 1-(4-cyclohexylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)ethanone Formula: C23H26O3S MolecularWeight: 382.51574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H26O3S/c24-21(19-9-7-18(8-10-19)17-5-2-1-3-6-17)16-27-20-11-12-22-23(15-20)26-14-4-13-25-22/h7-12,15,17H,1-6,13-14,16H2