tert-butyl 3-[3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-[2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethyl]phenyl]propanoate

Systemtic Name: tert-butyl 3-[3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-[2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethyl]phenyl]propanoate Openeye Name: tert-butyl 3-[3-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-5-[2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethyl]phenyl]propanoate CAS Name: 3-[3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-5-[2-[2-[2-(1-pyrrolidinyl)ethoxy]phenyl]ethyl]phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-5-[2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethyl]phenyl]propanoate Traditional Name: 3-[3-(2-phthalimidoethyl)-5-[2-[2-(2-pyrrolidinoethoxy)phenyl]ethyl]phenyl]propionic acid tert-butyl ester Formula: C37H44N2O5 MolecularWeight: 596.75566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=CC(=CC(=C1)CCC2=CC=CC=C2OCCN3CCCC3)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=CC(=CC(=C1)CCC2=CC=CC=C2OCCN3CCCC3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C37H44N2O5/c1-37(2,3)44-34(40)17-15-28-24-27(14-16-30-10-4-7-13-33(30)43-23-22-38-19-8-9-20-38)25-29(26-28)18-21-39-35(41)31-11-5-6-12-32(31)36(39)42/h4-7,10-13,24-26H,8-9,14-23H2,1-3H3