2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione

Systemtic Name: 2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione Openeye Name: 2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione CAS Name: 2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione IUPAC Name: 2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione Traditional Name: 2-(1,3-dithian-2-yl)-1-(4-methoxyphenyl)butane-1,3-dione Formula: C15H18O3S2 MolecularWeight: 310.43162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1SCCCS1)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)C(C1SCCCS1)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H18O3S2/c1-10(16)13(15-19-8-3-9-20-15)14(17)11-4-6-12(18-2)7-5-11/h4-7,13,15H,3,8-9H2,1-2H3