methyl 5-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoylamino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[[2-(1,3-benzodioxole-5-carbonylamino)acetyl]amino]-2-fluoro-benzoate CAS Name: 5-[[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-oxoethyl]amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[[2-(1,3-benzodioxole-5-carbonylamino)acetyl]amino]-2-fluorobenzoate Traditional Name: 2-fluoro-5-[[2-(piperonyloylamino)acetyl]amino]benzoic acid methyl ester Formula: C18H15FN2O6 MolecularWeight: 374.319903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15FN2O6/c1-25-18(24)12-7-11(3-4-13(12)19)21-16(22)8-20-17(23)10-2-5-14-15(6-10)27-9-26-14/h2-7H,8-9H2,1H3,(H,20,23)(H,21,22)