4-[5-(4-chlorophenyl)-2-ethyl-phenyl]-2,6-diethyl-2,6-dimethyl-5-oxidanyl-pyran-3-one

Systemtic Name: 4-[5-(4-chlorophenyl)-2-ethyl-phenyl]-2,6-diethyl-2,6-dimethyl-5-oxidanyl-pyran-3-one Openeye Name: 4-[5-(4-chlorophenyl)-2-ethyl-phenyl]-2,6-diethyl-5-hydroxy-2,6-dimethyl-pyran-3-one CAS Name: 4-[5-(4-chlorophenyl)-2-ethylphenyl]-2,6-diethyl-5-hydroxy-2,6-dimethyl-3-pyranone IUPAC Name: 4-[5-(4-chlorophenyl)-2-ethylphenyl]-2,6-diethyl-5-hydroxy-2,6-dimethylpyran-3-one Traditional Name: 4-[5-(4-chlorophenyl)-2-ethyl-phenyl]-2,6-diethyl-5-hydroxy-2,6-dimethyl-pyran-3-one Formula: C25H29ClO3 MolecularWeight: 412.94896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=CC=C(C=C2)Cl)C3=C(C(OC(C3=O)(C)CC)(C)CC)O

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=CC=C(C=C2)Cl)C3=C(C(OC(C3=O)(C)CC)(C)CC)O

InChI

InChI=1S/C25H29ClO3/c1-6-16-9-10-18(17-11-13-19(26)14-12-17)15-20(16)21-22(27)24(4,7-2)29-25(5,8-3)23(21)28/h9-15,27H,6-8H2,1-5H3