2-[1-(3,4-dimethoxyphenyl)-3-(pyridin-3-ylmethoxy)propyl]-3H-isoindol-1-one

Systemtic Name: 2-[1-(3,4-dimethoxyphenyl)-3-(pyridin-3-ylmethoxy)propyl]-3H-isoindol-1-one Openeye Name: 2-[1-(3,4-dimethoxyphenyl)-3-(3-pyridylmethoxy)propyl]isoindolin-1-one CAS Name: 2-[1-(3,4-dimethoxyphenyl)-3-(3-pyridinylmethoxy)propyl]-3H-isoindol-1-one IUPAC Name: 2-[1-(3,4-dimethoxyphenyl)-3-(pyridin-3-ylmethoxy)propyl]-3H-isoindol-1-one Traditional Name: 2-[1-(3,4-dimethoxyphenyl)-3-(3-pyridylmethoxy)propyl]isoindolin-1-one Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCOCC2=CN=CC=C2)N3CC4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCOCC2=CN=CC=C2)N3CC4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C25H26N2O4/c1-29-23-10-9-19(14-24(23)30-2)22(11-13-31-17-18-6-5-12-26-15-18)27-16-20-7-3-4-8-21(20)25(27)28/h3-10,12,14-15,22H,11,13,16-17H2,1-2H3