1,3-benzodioxol-5-ylmethyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3-pyrimidin-2-yloxyphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[3-(2-pyrimidinyloxy)phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Traditional Name: piperonyl-[3-(2-pyrimidyloxy)benzyl]ammonium Formula: C19H18N3O3+ MolecularWeight: 336.36452

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=CC=C3)OC4=NC=CC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=CC=C3)OC4=NC=CC=N4

InChI

InChI=1S/C19H17N3O3/c1-3-14(9-16(4-1)25-19-21-7-2-8-22-19)11-20-12-15-5-6-17-18(10-15)24-13-23-17/h1-10,20H,11-13H2/p+1