ethyl 2-ethyl-3-oxidanyl-3-(4-phenylmethoxyphenyl)pentanoate

Systemtic Name: ethyl 2-ethyl-3-oxidanyl-3-(4-phenylmethoxyphenyl)pentanoate Openeye Name: ethyl 3-(4-benzyloxyphenyl)-2-ethyl-3-hydroxy-pentanoate CAS Name: 2-ethyl-3-hydroxy-3-(4-phenylmethoxyphenyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-ethyl-3-hydroxy-3-(4-phenylmethoxyphenyl)pentanoate Traditional Name: 3-(4-benzoxyphenyl)-2-ethyl-3-hydroxy-valeric acid ethyl ester Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)C(CC)(C1=CC=C(C=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCC(C(=O)OCC)C(CC)(C1=CC=C(C=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C22H28O4/c1-4-20(21(23)25-6-3)22(24,5-2)18-12-14-19(15-13-18)26-16-17-10-8-7-9-11-17/h7-15,20,24H,4-6,16H2,1-3H3