2-(4-butan-2-ylphenyl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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