N-(1,3-benzodioxol-5-ylmethyl)-1-(3-pyrimidin-2-yloxyphenyl)methanamine hydrochloride

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-pyrimidin-2-yloxyphenyl)methanamine hydrochloride Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-pyrimidin-2-yloxyphenyl)methanamine hydrochloride CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(2-pyrimidinyloxy)phenyl]methanamine hydrochloride IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-pyrimidin-2-yloxyphenyl)methanamine hydrochloride Traditional Name: piperonyl-[3-(2-pyrimidyloxy)benzyl]amine hydrochloride Formula: C19H18ClN3O3 MolecularWeight: 371.81752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CC(=CC=C3)OC4=NC=CC=N4.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CC(=CC=C3)OC4=NC=CC=N4.Cl

InChI

InChI=1S/C19H17N3O3.ClH/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;1H