(2R)-2-(quinazolin-4-ylamino)pentanedioate

Systemtic Name: (2R)-2-(quinazolin-4-ylamino)pentanedioate Openeye Name: (2R)-2-(quinazolin-4-ylamino)pentanedioate CAS Name: (2R)-2-(4-quinazolinylamino)pentanedioate IUPAC Name: (2R)-2-(quinazolin-4-ylamino)pentanedioate Traditional Name: (2R)-2-(quinazolin-4-ylamino)glutarate Formula: C13H11N3O4-2 MolecularWeight: 273.24414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)N[C@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H13N3O4/c17-11(18)6-5-10(13(19)20)16-12-8-3-1-2-4-9(8)14-7-15-12/h1-4,7,10H,5-6H2,(H,17,18)(H,19,20)(H,14,15,16)/p-2/t10-/m1/s1