5-chloranyl-2-(4-methoxyphenyl)-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]-3H-isoindol-1-one

Systemtic Name: 5-chloranyl-2-(4-methoxyphenyl)-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]-3H-isoindol-1-one Openeye Name: 5-chloro-3-[2-(4-hydroxy-1-piperidyl)-2-oxo-ethyl]-2-(4-methoxyphenyl)isoindolin-1-one CAS Name: 5-chloro-3-[2-(4-hydroxy-1-piperidinyl)-2-oxoethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one IUPAC Name: 5-chloro-3-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one Traditional Name: 5-chloro-3-[2-(4-hydroxypiperidino)-2-keto-ethyl]-2-(4-methoxyphenyl)isoindolin-1-one Formula: C22H23ClN2O4 MolecularWeight: 414.88202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC(=C3)Cl)CC(=O)N4CCC(CC4)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC(=C3)Cl)CC(=O)N4CCC(CC4)O

InChI

InChI=1S/C22H23ClN2O4/c1-29-17-5-3-15(4-6-17)25-20(13-21(27)24-10-8-16(26)9-11-24)19-12-14(23)2-7-18(19)22(25)28/h2-7,12,16,20,26H,8-11,13H2,1H3