(4-azanylquinazolin-2-yl)methyl (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: (4-aminoquinazolin-2-yl)methyl (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-ethoxy-4-propoxyphenyl)-2-propenoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl (E)-3-(3-ethoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-ethoxy-4-propoxy-phenyl)acrylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OCC2=NC3=CC=CC=C3C(=N2)N)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)OCC

InChI

InChI=1S/C23H25N3O4/c1-3-13-29-19-11-9-16(14-20(19)28-4-2)10-12-22(27)30-15-21-25-18-8-6-5-7-17(18)23(24)26-21/h5-12,14H,3-4,13,15H2,1-2H3,(H2,24,25,26)/b12-10+