4,5-dipentoxy-2-[2-(4-phenylmethoxyphenyl)ethyl]-3H-isoindol-1-one

Systemtic Name: 4,5-dipentoxy-2-[2-(4-phenylmethoxyphenyl)ethyl]-3H-isoindol-1-one Openeye Name: 2-[2-(4-benzyloxyphenyl)ethyl]-4,5-dipentoxy-isoindolin-1-one CAS Name: 4,5-dipentoxy-2-[2-(4-phenylmethoxyphenyl)ethyl]-3H-isoindol-1-one IUPAC Name: 4,5-dipentoxy-2-[2-(4-phenylmethoxyphenyl)ethyl]-3H-isoindol-1-one Traditional Name: 4,5-diamoxy-2-[2-(4-benzoxyphenyl)ethyl]isoindolin-1-one Formula: C33H41NO4 MolecularWeight: 515.68294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4)OCCCCC

InChI

InChI=1S/C33H41NO4/c1-3-5-10-22-36-31-19-18-29-30(32(31)37-23-11-6-4-2)24-34(33(29)35)21-20-26-14-16-28(17-15-26)38-25-27-12-8-7-9-13-27/h7-9,12-19H,3-6,10-11,20-25H2,1-2H3