2-oxidanyl-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate

Systemtic Name: 2-oxidanyl-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate Openeye Name: 2-hydroxy-4-[(2-isopropylquinazolin-4-yl)amino]benzoate CAS Name: 2-hydroxy-4-[(2-propan-2-yl-4-quinazolinyl)amino]benzoate IUPAC Name: 2-hydroxy-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate Traditional Name: 2-hydroxy-4-[(2-isopropylquinazolin-4-yl)amino]benzoate Formula: C18H16N3O3- MolecularWeight: 322.33794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)[O-])O

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C18H17N3O3/c1-10(2)16-20-14-6-4-3-5-12(14)17(21-16)19-11-7-8-13(18(23)24)15(22)9-11/h3-10,22H,1-2H3,(H,23,24)(H,19,20,21)/p-1