4-(3-oxidanylpropylamino)quinazoline-2-carboxylic acid

Systemtic Name: 4-(3-oxidanylpropylamino)quinazoline-2-carboxylic acid Openeye Name: 4-(3-hydroxypropylamino)quinazoline-2-carboxylic acid CAS Name: 4-(3-hydroxypropylamino)-2-quinazolinecarboxylic acid IUPAC Name: 4-(3-hydroxypropylamino)quinazoline-2-carboxylic acid Traditional Name: 4-(3-hydroxypropylamino)quinazoline-2-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=O)O)NCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(=O)O)NCCCO

InChI

InChI=1S/C12H13N3O3/c16-7-3-6-13-10-8-4-1-2-5-9(8)14-11(15-10)12(17)18/h1-2,4-5,16H,3,6-7H2,(H,17,18)(H,13,14,15)