(4-azanylquinazolin-2-yl)methyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 1,3-benzodioxole-5-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13N3O4/c18-16-11-3-1-2-4-12(11)19-15(20-16)8-22-17(21)10-5-6-13-14(7-10)24-9-23-13/h1-7H,8-9H2,(H2,18,19,20)