2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-fluorophenyl)-2-phenyl-ethanamide; ethanedioic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-fluorophenyl)-2-phenyl-ethanamide; ethanedioic acid Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-fluorophenyl)-2-phenyl-acetamide; oxalic acid CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-fluorophenyl)-2-phenylacetamide; oxalic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-fluorophenyl)-2-phenylacetamide; oxalic acid Traditional Name: N-(4-fluorophenyl)-2-phenyl-2-(piperonylamino)acetamide; oxalic acid Formula: C24H21FN2O7 MolecularWeight: 468.431143

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H19FN2O3.C2H2O4/c23-17-7-9-18(10-8-17)25-22(26)21(16-4-2-1-3-5-16)24-13-15-6-11-19-20(12-15)28-14-27-19;3-1(4)2(5)6/h1-12,21,24H,13-14H2,(H,25,26);(H,3,4)(H,5,6)