(5S)-5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxan-2-one

Systemtic Name: (5S)-5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxan-2-one Openeye Name: (5S)-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydropyran-2-one CAS Name: (5S)-5-(3-cyclopentyloxy-4-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxanone IUPAC Name: (5S)-5-(3-cyclopentyloxy-4-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxan-2-one Traditional Name: (5S)-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-vanillyl-tetrahydropyran-2-one Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)OC)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)OC)OC4CCCC4

InChI

InChI=1S/C25H30O6/c1-28-22-10-8-17(14-24(22)31-20-5-3-4-6-20)19-13-18(25(27)30-15-19)11-16-7-9-21(26)23(12-16)29-2/h7-10,12,14,18-20,26H,3-6,11,13,15H2,1-2H3/t18?,19-/m1/s1