4-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanyl-benzenecarbonitrile Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-hydroxy-benzonitrile CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-hydroxybenzonitrile IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-hydroxybenzonitrile Traditional Name: 2-hydroxy-4-(piperonylamino)benzonitrile Formula: C15H12N2O3 MolecularWeight: 268.26738

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=CC(=C(C=C3)C#N)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=CC(=C(C=C3)C#N)O

InChI

InChI=1S/C15H12N2O3/c16-7-11-2-3-12(6-13(11)18)17-8-10-1-4-14-15(5-10)20-9-19-14/h1-6,17-18H,8-9H2