4'-[methyl(phenyl)amino]spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]-2'-one

Systemtic Name: 4'-[methyl(phenyl)amino]spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]-2'-one Openeye Name: 4'-(N-methylanilino)spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]-2'-one CAS Name: 4'-(N-methylanilino)-2'-spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]one IUPAC Name: 4'-(N-methylanilino)spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]-2'-one Traditional Name: 4'-(N-methylanilino)spiro[1,3-dithiane-2,3'-5,6,7,8,9,10-hexahydro-4H-cycloocta[b]pyran]-2'-one Formula: C21H27NO2S2 MolecularWeight: 389.57458

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1C2=C(CCCCCC2)OC(=O)C13SCCCS3)C4=CC=CC=C4

Isomeric SMILES

CN(C1C2=C(CCCCCC2)OC(=O)C13SCCCS3)C4=CC=CC=C4

InChI

InChI=1S/C21H27NO2S2/c1-22(16-10-5-4-6-11-16)19-17-12-7-2-3-8-13-18(17)24-20(23)21(19)25-14-9-15-26-21/h4-6,10-11,19H,2-3,7-9,12-15H2,1H3