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

Systemtic Name: 3-(3-methoxy-4-phenylmethoxy-phenyl)-2-(2-pyridin-2-ylethyl)-3H-isoindol-1-one Openeye Name: 3-(4-benzyloxy-3-methoxy-phenyl)-2-[2-(2-pyridyl)ethyl]isoindolin-1-one CAS Name: 3-(3-methoxy-4-phenylmethoxyphenyl)-2-[2-(2-pyridinyl)ethyl]-3H-isoindol-1-one IUPAC Name: 3-(3-methoxy-4-phenylmethoxyphenyl)-2-(2-pyridin-2-ylethyl)-3H-isoindol-1-one Traditional Name: 3-(4-benzoxy-3-methoxy-phenyl)-2-[2-(2-pyridyl)ethyl]isoindolin-1-one Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3=CC=CC=C3C(=O)N2CCC4=CC=CC=N4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3=CC=CC=C3C(=O)N2CCC4=CC=CC=N4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H26N2O3/c1-33-27-19-22(14-15-26(27)34-20-21-9-3-2-4-10-21)28-24-12-5-6-13-25(24)29(32)31(28)18-16-23-11-7-8-17-30-23/h2-15,17,19,28H,16,18,20H2,1H3