4-(1,3-benzodioxol-5-ylmethylamino)-6-methoxy-quinazoline-2-carbaldehyde

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-methoxy-quinazoline-2-carbaldehyde Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-methoxy-quinazoline-2-carbaldehyde CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-methoxy-2-quinazolinecarboxaldehyde IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-methoxyquinazoline-2-carbaldehyde Traditional Name: 6-methoxy-4-(piperonylamino)quinazoline-2-carbaldehyde Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C2NCC3=CC4=C(C=C3)OCO4)C=O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C2NCC3=CC4=C(C=C3)OCO4)C=O

InChI

InChI=1S/C18H15N3O4/c1-23-12-3-4-14-13(7-12)18(21-17(9-22)20-14)19-8-11-2-5-15-16(6-11)25-10-24-15/h2-7,9H,8,10H2,1H3,(H,19,20,21)