2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-bis(oxidanylidene)isoindol-5-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-bis(oxidanylidene)isoindol-5-yl]oxybenzenecarbonitrile Openeye Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-dioxo-isoindolin-5-yl]oxybenzonitrile CAS Name: 2-[[2-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,3-dioxo-5-isoindolyl]oxy]benzonitrile IUPAC Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-dioxoisoindol-5-yl]oxybenzonitrile Traditional Name: 2-[1,3-diketo-2-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]isoindolin-5-yl]oxybenzonitrile Formula: C28H25N3O5 MolecularWeight: 483.5152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4C#N)OCCN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4C#N)OCCN5CCCC5

InChI

InChI=1S/C28H25N3O5/c1-34-26-16-20(8-11-25(26)35-15-14-30-12-4-5-13-30)31-27(32)22-10-9-21(17-23(22)28(31)33)36-24-7-3-2-6-19(24)18-29/h2-3,6-11,16-17H,4-5,12-15H2,1H3