3-[(4-tert-butylphenyl)methoxy]-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenyl-isoindol-1-one

Systemtic Name: 3-[(4-tert-butylphenyl)methoxy]-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenyl-isoindol-1-one Openeye Name: 3-[(4-tert-butylphenyl)methoxy]-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenyl-isoindolin-1-one CAS Name: 3-[(4-tert-butylphenyl)methoxy]-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenyl-1-isoindolone IUPAC Name: 3-[(4-tert-butylphenyl)methoxy]-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenylisoindol-1-one Traditional Name: 3-(4-tert-butylbenzyl)oxy-2-[2-(1H-imidazol-5-yl)ethyl]-3-phenyl-isoindolin-1-one Formula: C30H31N3O2 MolecularWeight: 465.58604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2(C3=CC=CC=C3C(=O)N2CCC4=CN=CN4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2(C3=CC=CC=C3C(=O)N2CCC4=CN=CN4)C5=CC=CC=C5

InChI

InChI=1S/C30H31N3O2/c1-29(2,3)23-15-13-22(14-16-23)20-35-30(24-9-5-4-6-10-24)27-12-8-7-11-26(27)28(34)33(30)18-17-25-19-31-21-32-25/h4-16,19,21H,17-18,20H2,1-3H3,(H,31,32)