(4-azanylquinazolin-2-yl)methyl (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Openeye Name: (4-aminoquinazolin-2-yl)methyl (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,3-dimethoxyphenyl)-2-propenoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,3-dimethoxyphenyl)acrylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)OCC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)OCC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C20H19N3O4/c1-25-16-9-5-6-13(19(16)26-2)10-11-18(24)27-12-17-22-15-8-4-3-7-14(15)20(21)23-17/h3-11H,12H2,1-2H3,(H2,21,22,23)/b11-10+