[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-fluoranylbenzoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-fluoranylbenzoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-1-phenyl-ethyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-1-phenylethyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [2-keto-1-phenyl-2-(piperonylamino)ethyl] ester Formula: C23H18FNO5 MolecularWeight: 407.391123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18FNO5/c24-18-9-7-17(8-10-18)23(27)30-21(16-4-2-1-3-5-16)22(26)25-13-15-6-11-19-20(12-15)29-14-28-19/h1-12,21H,13-14H2,(H,25,26)