3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]cyclopentan-1-one

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]cyclopentan-1-one Openeye Name: 2-[(4-benzyloxy-3-methoxy-phenyl)methyl]-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]cyclopentanone CAS Name: 3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-2-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-cyclopentanone IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-2-[(3-methoxy-4-phenylmethoxyphenyl)methyl]cyclopentan-1-one Traditional Name: 2-(4-benzoxy-3-methoxy-benzyl)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]cyclopentanone Formula: C32H36O5S2 MolecularWeight: 564.75524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(SCCCS2)C3CCC(=O)C3CC4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(SCCCS2)C3CCC(=O)C3CC4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)OC

InChI

InChI=1S/C32H36O5S2/c1-34-28-15-11-24(20-31(28)36-3)32(38-16-7-17-39-32)26-12-13-27(33)25(26)18-23-10-14-29(30(19-23)35-2)37-21-22-8-5-4-6-9-22/h4-6,8-11,14-15,19-20,25-26H,7,12-13,16-18,21H2,1-3H3