6-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]hexanoic acid

Systemtic Name: 6-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]hexanoic acid Openeye Name: 6-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]hexanoic acid CAS Name: 6-[[2-(4-tert-butylphenyl)-4-quinazolinyl]amino]hexanoic acid IUPAC Name: 6-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]hexanoic acid Traditional Name: 6-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]hexanoic acid Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCCCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCCCCC(=O)O

InChI

InChI=1S/C24H29N3O2/c1-24(2,3)18-14-12-17(13-15-18)22-26-20-10-7-6-9-19(20)23(27-22)25-16-8-4-5-11-21(28)29/h6-7,9-10,12-15H,4-5,8,11,16H2,1-3H3,(H,28,29)(H,25,26,27)