2-[2,4-bis(oxidanylidene)-3-(pyridin-2-ylmethyl)quinazolin-1-yl]ethanoic acid

Systemtic Name: 2-[2,4-bis(oxidanylidene)-3-(pyridin-2-ylmethyl)quinazolin-1-yl]ethanoic acid Openeye Name: 2-[2,4-dioxo-3-(2-pyridylmethyl)quinazolin-1-yl]acetic acid CAS Name: 2-[2,4-dioxo-3-(2-pyridinylmethyl)-1-quinazolinyl]acetic acid IUPAC Name: 2-[2,4-dioxo-3-(pyridin-2-ylmethyl)quinazolin-1-yl]acetic acid Traditional Name: 2-[2,4-diketo-3-(2-pyridylmethyl)quinazolin-1-yl]acetic acid Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2CC(=O)O)CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2CC(=O)O)CC3=CC=CC=N3

InChI

InChI=1S/C16H13N3O4/c20-14(21)10-18-13-7-2-1-6-12(13)15(22)19(16(18)23)9-11-5-3-4-8-17-11/h1-8H,9-10H2,(H,20,21)