2-[(2-phenylquinazolin-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[(2-phenylquinazolin-4-yl)azaniumyl]ethanoate Openeye Name: 2-[(2-phenylquinazolin-4-yl)ammonio]acetate CAS Name: 2-[(2-phenyl-4-quinazolinyl)ammonio]acetate IUPAC Name: 2-[(2-phenylquinazolin-4-yl)azaniumyl]acetate Traditional Name: 2-[(2-phenylquinazolin-4-yl)ammonio]acetate Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)[NH2+]CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)[NH2+]CC(=O)[O-]

InChI

InChI=1S/C16H13N3O2/c20-14(21)10-17-16-12-8-4-5-9-13(12)18-15(19-16)11-6-2-1-3-7-11/h1-9H,10H2,(H,20,21)(H,17,18,19)