ethyl 4,4-bis(3-methyl-4-oxidanyl-phenyl)pentanoate

Systemtic Name: ethyl 4,4-bis(3-methyl-4-oxidanyl-phenyl)pentanoate Openeye Name: ethyl 4,4-bis(4-hydroxy-3-methyl-phenyl)pentanoate CAS Name: 4,4-bis(4-hydroxy-3-methylphenyl)pentanoic acid ethyl ester IUPAC Name: ethyl 4,4-bis(4-hydroxy-3-methylphenyl)pentanoate Traditional Name: 4,4-bis(4-hydroxy-3-methyl-phenyl)valeric acid ethyl ester Formula: C21H26O4 MolecularWeight: 342.42874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)(C1=CC(=C(C=C1)O)C)C2=CC(=C(C=C2)O)C

Isomeric SMILES

CCOC(=O)CCC(C)(C1=CC(=C(C=C1)O)C)C2=CC(=C(C=C2)O)C

InChI

InChI=1S/C21H26O4/c1-5-25-20(24)10-11-21(4,16-6-8-18(22)14(2)12-16)17-7-9-19(23)15(3)13-17/h6-9,12-13,22-23H,5,10-11H2,1-4H3