(2R)-2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]pentanedioate

Systemtic Name: (2R)-2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]pentanedioate Openeye Name: (2R)-2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]pentanedioate CAS Name: (2R)-2-[[2-(4-tert-butylphenyl)-4-quinazolinyl]amino]pentanedioate IUPAC Name: (2R)-2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]pentanedioate Traditional Name: (2R)-2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]glutarate Formula: C23H23N3O4-2 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N[C@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C23H25N3O4/c1-23(2,3)15-10-8-14(9-11-15)20-24-17-7-5-4-6-16(17)21(26-20)25-18(22(29)30)12-13-19(27)28/h4-11,18H,12-13H2,1-3H3,(H,27,28)(H,29,30)(H,24,25,26)/p-2/t18-/m1/s1