2-(4-tert-butylphenyl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-(4-tert-butylphenyl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-(4-tert-butylphenyl)-7-(6-quinolylmethylamino)isoindolin-1-one CAS Name: 2-(4-tert-butylphenyl)-7-(6-quinolinylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-(4-tert-butylphenyl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-(4-tert-butylphenyl)-7-(6-quinolylmethylamino)isoindolin-1-one Formula: C28H27N3O MolecularWeight: 421.53348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C28H27N3O/c1-28(2,3)22-10-12-23(13-11-22)31-18-21-6-4-8-25(26(21)27(31)32)30-17-19-9-14-24-20(16-19)7-5-15-29-24/h4-16,30H,17-18H2,1-3H3