5-methoxy-4-pentoxy-2-(2-pyridin-4-ylethyl)-3H-isoindol-1-one

Systemtic Name: 5-methoxy-4-pentoxy-2-(2-pyridin-4-ylethyl)-3H-isoindol-1-one Openeye Name: 5-methoxy-4-pentoxy-2-[2-(4-pyridyl)ethyl]isoindolin-1-one CAS Name: 5-methoxy-4-pentoxy-2-(2-pyridin-4-ylethyl)-3H-isoindol-1-one IUPAC Name: 5-methoxy-4-pentoxy-2-(2-pyridin-4-ylethyl)-3H-isoindol-1-one Traditional Name: 4-amoxy-5-methoxy-2-[2-(4-pyridyl)ethyl]isoindolin-1-one Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC2=C1CN(C2=O)CCC3=CC=NC=C3)OC

Isomeric SMILES

CCCCCOC1=C(C=CC2=C1CN(C2=O)CCC3=CC=NC=C3)OC

InChI

InChI=1S/C21H26N2O3/c1-3-4-5-14-26-20-18-15-23(13-10-16-8-11-22-12-9-16)21(24)17(18)6-7-19(20)25-2/h6-9,11-12H,3-5,10,13-15H2,1-2H3