methyl 4-[4-(2-hydroxyphenyl)-4-oxidanyl-piperidin-1-yl]-2,2-diphenyl-butanoate

Systemtic Name: methyl 4-[4-(2-hydroxyphenyl)-4-oxidanyl-piperidin-1-yl]-2,2-diphenyl-butanoate Openeye Name: methyl 4-[4-hydroxy-4-(2-hydroxyphenyl)-1-piperidyl]-2,2-diphenyl-butanoate CAS Name: 4-[4-hydroxy-4-(2-hydroxyphenyl)-1-piperidinyl]-2,2-diphenylbutanoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-4-(2-hydroxyphenyl)piperidin-1-yl]-2,2-diphenylbutanoate Traditional Name: 4-[4-hydroxy-4-(2-hydroxyphenyl)piperidino]-2,2-diphenyl-butyric acid methyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCN1CCC(CC1)(C2=CC=CC=C2O)O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CCN1CCC(CC1)(C2=CC=CC=C2O)O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31NO4/c1-33-26(31)28(22-10-4-2-5-11-22,23-12-6-3-7-13-23)18-21-29-19-16-27(32,17-20-29)24-14-8-9-15-25(24)30/h2-15,30,32H,16-21H2,1H3