3-(2-phenyl-1,3-dithian-2-yl)cycloheptan-1-one

Systemtic Name: 3-(2-phenyl-1,3-dithian-2-yl)cycloheptan-1-one Openeye Name: 3-(2-phenyl-1,3-dithian-2-yl)cycloheptanone CAS Name: 3-(2-phenyl-1,3-dithian-2-yl)-1-cycloheptanone IUPAC Name: 3-(2-phenyl-1,3-dithian-2-yl)cycloheptan-1-one Traditional Name: 3-(2-phenyl-1,3-dithian-2-yl)cycloheptanone Formula: C17H22OS2 MolecularWeight: 306.48598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)CC(C1)C2(SCCCS2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)CC(C1)C2(SCCCS2)C3=CC=CC=C3

InChI

InChI=1S/C17H22OS2/c18-16-10-5-4-9-15(13-16)17(19-11-6-12-20-17)14-7-2-1-3-8-14/h1-3,7-8,15H,4-6,9-13H2