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

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazoline-2-carbaldehyde Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazoline-2-carbaldehyde CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinecarboxaldehyde IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazoline-2-carbaldehyde Traditional Name: 6-chloro-4-(piperonylamino)quinazoline-2-carbaldehyde Formula: C17H12ClN3O3 MolecularWeight: 341.74848

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=C3C=C(C=C4)Cl)C=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=C3C=C(C=C4)Cl)C=O

InChI

InChI=1S/C17H12ClN3O3/c18-11-2-3-13-12(6-11)17(21-16(8-22)20-13)19-7-10-1-4-14-15(5-10)24-9-23-14/h1-6,8H,7,9H2,(H,19,20,21)