4,4-bis(3,5-dimethyl-4-oxidanyl-phenyl)pentanoic acid

Systemtic Name: 4,4-bis(3,5-dimethyl-4-oxidanyl-phenyl)pentanoic acid Openeye Name: 4,4-bis(4-hydroxy-3,5-dimethyl-phenyl)pentanoic acid CAS Name: 4,4-bis(4-hydroxy-3,5-dimethylphenyl)pentanoic acid IUPAC Name: 4,4-bis(4-hydroxy-3,5-dimethylphenyl)pentanoic acid Traditional Name: 4,4-bis(4-hydroxy-3,5-dimethyl-phenyl)valeric acid Formula: C21H26O4 MolecularWeight: 342.42874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(C)(CCC(=O)O)C2=CC(=C(C(=C2)C)O)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(C)(CCC(=O)O)C2=CC(=C(C(=C2)C)O)C

InChI

InChI=1S/C21H26O4/c1-12-8-16(9-13(2)19(12)24)21(5,7-6-18(22)23)17-10-14(3)20(25)15(4)11-17/h8-11,24-25H,6-7H2,1-5H3,(H,22,23)