2-[(6-oxidanylidenepyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid hydrochloride

Systemtic Name: 2-[(6-oxidanylidenepyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid hydrochloride Openeye Name: 2-[(6-oxopyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid hydrochloride CAS Name: 2-[(6-oxo-2-pyrimido[2,1-b]quinazolinyl)amino]benzoic acid hydrochloride IUPAC Name: 2-[(6-oxopyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid hydrochloride Traditional Name: 2-[(6-ketopyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid hydrochloride Formula: C18H13ClN4O3 MolecularWeight: 368.77382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N3C=CC(=NC3=N2)NC4=CC=CC=C4C(=O)O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N3C=CC(=NC3=N2)NC4=CC=CC=C4C(=O)O.Cl

InChI

InChI=1S/C18H12N4O3.ClH/c23-16-11-5-1-3-7-13(11)20-18-21-15(9-10-22(16)18)19-14-8-4-2-6-12(14)17(24)25;/h1-10H,(H,24,25)(H,19,20,21);1H