1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-chloranylphenoxy)propan-2-ol

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-chloranylphenoxy)propan-2-ol Openeye Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-chlorophenoxy)propan-2-ol CAS Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-chlorophenoxy)-2-propanol IUPAC Name: 1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-chlorophenoxy)propan-2-ol Traditional Name: 1-(4-chlorophenoxy)-3-(piperonylamino)propan-2-ol Formula: C17H18ClNO4 MolecularWeight: 335.78212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C17H18ClNO4/c18-13-2-4-15(5-3-13)21-10-14(20)9-19-8-12-1-6-16-17(7-12)23-11-22-16/h1-7,14,19-20H,8-11H2