2-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-cyclopentyl-5-(4-hydroxyphenyl)sulfanyl-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 2-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-cyclopentyl-5-(4-hydroxyphenyl)sulfanyl-6-oxidanyl-3H-pyran-4-one Openeye Name: 2-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-(4-hydroxyphenyl)sulfanyl-3H-pyran-4-one CAS Name: 2-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-[(4-hydroxyphenyl)thio]-3H-pyran-4-one IUPAC Name: 2-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-(4-hydroxyphenyl)sulfanyl-3H-pyran-4-one Traditional Name: 2-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-[(4-hydroxyphenyl)thio]-3H-pyran-4-one Formula: C25H27ClO5S MolecularWeight: 474.99688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC2(CC(=O)C(=C(O2)O)SC3=CC=C(C=C3)O)C4CCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CCC2(CC(=O)C(=C(O2)O)SC3=CC=C(C=C3)O)C4CCCC4)Cl

InChI

InChI=1S/C25H27ClO5S/c1-30-22-11-6-16(14-20(22)26)12-13-25(17-4-2-3-5-17)15-21(28)23(24(29)31-25)32-19-9-7-18(27)8-10-19/h6-11,14,17,27,29H,2-5,12-13,15H2,1H3