5,6-dimethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[4-(2-pyrrolidinoethoxy)phenyl]isoindolin-1-one Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CN(C2=O)C3=CC=C(C=C3)OCCN4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CN(C2=O)C3=CC=C(C=C3)OCCN4CCCC4)OC

InChI

InChI=1S/C22H26N2O4/c1-26-20-13-16-15-24(22(25)19(16)14-21(20)27-2)17-5-7-18(8-6-17)28-12-11-23-9-3-4-10-23/h5-8,13-14H,3-4,9-12,15H2,1-2H3