2-[2-(4-hydroxyphenyl)ethyl]-7-pentoxy-3H-isoindol-1-one

Systemtic Name: 2-[2-(4-hydroxyphenyl)ethyl]-7-pentoxy-3H-isoindol-1-one Openeye Name: 2-[2-(4-hydroxyphenyl)ethyl]-7-pentoxy-isoindolin-1-one CAS Name: 2-[2-(4-hydroxyphenyl)ethyl]-7-pentoxy-3H-isoindol-1-one IUPAC Name: 2-[2-(4-hydroxyphenyl)ethyl]-7-pentoxy-3H-isoindol-1-one Traditional Name: 7-amoxy-2-[2-(4-hydroxyphenyl)ethyl]isoindolin-1-one Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC2=C1C(=O)N(C2)CCC3=CC=C(C=C3)O

Isomeric SMILES

CCCCCOC1=CC=CC2=C1C(=O)N(C2)CCC3=CC=C(C=C3)O

InChI

InChI=1S/C21H25NO3/c1-2-3-4-14-25-19-7-5-6-17-15-22(21(24)20(17)19)13-12-16-8-10-18(23)11-9-16/h5-11,23H,2-4,12-15H2,1H3