(4-azanylquinazolin-2-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C19H17N3O4/c20-19-13-3-1-2-4-14(13)21-17(22-19)10-24-18(23)8-6-12-5-7-15-16(9-12)26-11-25-15/h1-5,7,9H,6,8,10-11H2,(H2,20,21,22)