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(2R)-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanedioic acid

Systemtic Name:	(2R)-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanedioic acid
Openeye Name:	(2R)-2-[(2-isopropylquinazolin-4-yl)amino]pentanedioic acid
CAS Name:	(2R)-2-[(2-propan-2-yl-4-quinazolinyl)amino]pentanedioic acid
IUPAC Name:	(2R)-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanedioic acid
Traditional Name:	(2R)-2-[(2-isopropylquinazolin-4-yl)amino]glutaric acid
Formula:	C₁₆H₁₉N₃O₄
MolecularWeight:	317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)N[C@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C16H19N3O4/c1-9(2)14-17-11-6-4-3-5-10(11)15(19-14)18-12(16(22)23)7-8-13(20)21/h3-6,9,12H,7-8H2,1-2H3,(H,20,21)(H,22,23)(H,17,18,19)/t12-/m1/s1

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