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

Systemtic Name: (2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-phenylphenoxy)propan-2-ol Openeye Name: (2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-phenylphenoxy)propan-2-ol CAS Name: (2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-phenylphenoxy)-2-propanol IUPAC Name: (2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(4-phenylphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-phenylphenoxy)-3-(piperonylamino)propan-2-ol Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC(COC3=CC=C(C=C3)C4=CC=CC=C4)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC[C@@H](COC3=CC=C(C=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C23H23NO4/c25-20(14-24-13-17-6-11-22-23(12-17)28-16-27-22)15-26-21-9-7-19(8-10-21)18-4-2-1-3-5-18/h1-12,20,24-25H,13-16H2/t20-/m0/s1