(4-azanylquinazolin-2-yl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)OCC(C)C

InChI

InChI=1S/C22H25N3O4/c1-4-27-19-11-15(9-10-18(19)28-12-14(2)3)22(26)29-13-20-24-17-8-6-5-7-16(17)21(23)25-20/h5-11,14H,4,12-13H2,1-3H3,(H2,23,24,25)