3,3-dibutyl-5-methoxy-4-[(4-methoxyphenyl)methyl]-2H-isoindol-1-one

Systemtic Name: 3,3-dibutyl-5-methoxy-4-[(4-methoxyphenyl)methyl]-2H-isoindol-1-one Openeye Name: 3,3-dibutyl-5-methoxy-4-[(4-methoxyphenyl)methyl]isoindolin-1-one CAS Name: 3,3-dibutyl-5-methoxy-4-[(4-methoxyphenyl)methyl]-2H-isoindol-1-one IUPAC Name: 3,3-dibutyl-5-methoxy-4-[(4-methoxyphenyl)methyl]-2H-isoindol-1-one Traditional Name: 3,3-dibutyl-5-methoxy-4-p-anisyl-isoindolin-1-one Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(C=CC(=C2CC3=CC=C(C=C3)OC)OC)C(=O)N1)CCCC

Isomeric SMILES

CCCCC1(C2=C(C=CC(=C2CC3=CC=C(C=C3)OC)OC)C(=O)N1)CCCC

InChI

InChI=1S/C25H33NO3/c1-5-7-15-25(16-8-6-2)23-20(24(27)26-25)13-14-22(29-4)21(23)17-18-9-11-19(28-3)12-10-18/h9-14H,5-8,15-17H2,1-4H3,(H,26,27)