2-cyclohexyl-3,3-bis(4-hydroxyphenyl)isoindol-1-one

Systemtic Name: 2-cyclohexyl-3,3-bis(4-hydroxyphenyl)isoindol-1-one Openeye Name: 2-cyclohexyl-3,3-bis(4-hydroxyphenyl)isoindolin-1-one CAS Name: 2-cyclohexyl-3,3-bis(4-hydroxyphenyl)-1-isoindolone IUPAC Name: 2-cyclohexyl-3,3-bis(4-hydroxyphenyl)isoindol-1-one Traditional Name: 2-cyclohexyl-3,3-bis(4-hydroxyphenyl)isoindolin-1-one Formula: C26H25NO3 MolecularWeight: 399.4816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=CC=CC=C3C2(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=CC=CC=C3C2(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C26H25NO3/c28-21-14-10-18(11-15-21)26(19-12-16-22(29)17-13-19)24-9-5-4-8-23(24)25(30)27(26)20-6-2-1-3-7-20/h4-5,8-17,20,28-29H,1-3,6-7H2