6-cyclopentyl-6-[(4-methoxyphenyl)sulfanylmethyl]oxane-2,4-dione

Systemtic Name: 6-cyclopentyl-6-[(4-methoxyphenyl)sulfanylmethyl]oxane-2,4-dione Openeye Name: 6-cyclopentyl-6-[(4-methoxyphenyl)sulfanylmethyl]tetrahydropyran-2,4-dione CAS Name: 6-cyclopentyl-6-[[(4-methoxyphenyl)thio]methyl]oxane-2,4-dione IUPAC Name: 6-cyclopentyl-6-[(4-methoxyphenyl)sulfanylmethyl]oxane-2,4-dione Traditional Name: 6-cyclopentyl-6-[[(4-methoxyphenyl)thio]methyl]tetrahydropyran-2,4-quinone Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC2(CC(=O)CC(=O)O2)C3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)SCC2(CC(=O)CC(=O)O2)C3CCCC3

InChI

InChI=1S/C18H22O4S/c1-21-15-6-8-16(9-7-15)23-12-18(13-4-2-3-5-13)11-14(19)10-17(20)22-18/h6-9,13H,2-5,10-12H2,1H3