3-methoxy-3-(3-methoxy-4-phenylmethoxy-phenyl)-2-(2-pyridin-2-ylethyl)isoindol-1-one

Systemtic Name: 3-methoxy-3-(3-methoxy-4-phenylmethoxy-phenyl)-2-(2-pyridin-2-ylethyl)isoindol-1-one Openeye Name: 3-(4-benzyloxy-3-methoxy-phenyl)-3-methoxy-2-[2-(2-pyridyl)ethyl]isoindolin-1-one CAS Name: 3-methoxy-3-(3-methoxy-4-phenylmethoxyphenyl)-2-[2-(2-pyridinyl)ethyl]-1-isoindolone IUPAC Name: 3-methoxy-3-(3-methoxy-4-phenylmethoxyphenyl)-2-(2-pyridin-2-ylethyl)isoindol-1-one Traditional Name: 3-(4-benzoxy-3-methoxy-phenyl)-3-methoxy-2-[2-(2-pyridyl)ethyl]isoindolin-1-one Formula: C30H28N2O4 MolecularWeight: 480.55432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)N2CCC4=CC=CC=N4)OC)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)N2CCC4=CC=CC=N4)OC)OCC5=CC=CC=C5

InChI

InChI=1S/C30H28N2O4/c1-34-28-20-23(15-16-27(28)36-21-22-10-4-3-5-11-22)30(35-2)26-14-7-6-13-25(26)29(33)32(30)19-17-24-12-8-9-18-31-24/h3-16,18,20H,17,19,21H2,1-2H3