2-(quinazolin-4-ylamino)pentanedioic acid

Systemtic Name: 2-(quinazolin-4-ylamino)pentanedioic acid Openeye Name: 2-(quinazolin-4-ylamino)pentanedioic acid CAS Name: 2-(4-quinazolinylamino)pentanedioic acid IUPAC Name: 2-(quinazolin-4-ylamino)pentanedioic acid Traditional Name: 2-(quinazolin-4-ylamino)glutaric acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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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)NC(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)