4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylbenzene-1,3,5-triol

Systemtic Name: 4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylbenzene-1,3,5-triol Openeye Name: 4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylbenzene-1,3,5-triol CAS Name: 4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylbenzene-1,3,5-triol IUPAC Name: 4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylbenzene-1,3,5-triol Traditional Name: 4-[3,3-bis(4-hydroxyphenyl)propyl]phenol; 2-methylphloroglucinol Formula: C28H28O6 MolecularWeight: 460.51832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1O)O)O.C1=CC(=CC=C1CCC(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)O

Isomeric SMILES

CC1=C(C=C(C=C1O)O)O.C1=CC(=CC=C1CCC(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)O

InChI

InChI=1S/C21H20O3.C7H8O3/c22-18-8-1-15(2-9-18)3-14-21(16-4-10-19(23)11-5-16)17-6-12-20(24)13-7-17;1-4-6(9)2-5(8)3-7(4)10/h1-2,4-13,21-24H,3,14H2;2-3,8-10H,1H3