3-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate

Systemtic Name: 3-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate Openeye Name: 3-[(2-isopropylquinazolin-4-yl)amino]benzoate CAS Name: 3-[(2-propan-2-yl-4-quinazolinyl)amino]benzoate IUPAC Name: 3-[(2-propan-2-ylquinazolin-4-yl)amino]benzoate Traditional Name: 3-[(2-isopropylquinazolin-4-yl)amino]benzoate Formula: C18H16N3O2- MolecularWeight: 306.33854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O2/c1-11(2)16-20-15-9-4-3-8-14(15)17(21-16)19-13-7-5-6-12(10-13)18(22)23/h3-11H,1-2H3,(H,22,23)(H,19,20,21)/p-1