methyl 2-[[5-(1,3-benzodioxol-5-ylcarbonylamino)-2-fluoranyl-phenyl]amino]ethanoate

Systemtic Name: methyl 2-[[5-(1,3-benzodioxol-5-ylcarbonylamino)-2-fluoranyl-phenyl]amino]ethanoate Openeye Name: methyl 2-[5-(1,3-benzodioxole-5-carbonylamino)-2-fluoro-anilino]acetate CAS Name: 2-[5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-2-fluoroanilino]acetic acid methyl ester IUPAC Name: methyl 2-[5-(1,3-benzodioxole-5-carbonylamino)-2-fluoroanilino]acetate Traditional Name: 2-[2-fluoro-5-(piperonyloylamino)anilino]acetic acid methyl ester Formula: C17H15FN2O5 MolecularWeight: 346.309803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

COC(=O)CNC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C17H15FN2O5/c1-23-16(21)8-19-13-7-11(3-4-12(13)18)20-17(22)10-2-5-14-15(6-10)25-9-24-14/h2-7,19H,8-9H2,1H3,(H,20,22)