1,3-benzodioxol-5-ylmethyl(3-phenylprop-2-ynyl)azanium chloride

Systemtic Name: 1,3-benzodioxol-5-ylmethyl(3-phenylprop-2-ynyl)azanium chloride Openeye Name: 1,3-benzodioxol-5-ylmethyl(3-phenylprop-2-ynyl)ammonium chloride CAS Name: 1,3-benzodioxol-5-ylmethyl(3-phenylprop-2-ynyl)ammonium chloride IUPAC Name: 1,3-benzodioxol-5-ylmethyl(3-phenylprop-2-ynyl)azanium chloride Traditional Name: 3-phenylprop-2-ynyl(piperonyl)ammonium chloride Formula: C17H16ClNO2 MolecularWeight: 301.76744

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC#CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC#CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C17H15NO2.ClH/c1-2-5-14(6-3-1)7-4-10-18-12-15-8-9-16-17(11-15)20-13-19-16;/h1-3,5-6,8-9,11,18H,10,12-13H2;1H