[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [2-(3-fluoro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-methylanilino)-2-oxoethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C19H17FN2O6 MolecularWeight: 388.346483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C19H17FN2O6/c1-11-2-4-13(7-14(11)20)22-17(23)9-26-18(24)8-21-19(25)12-3-5-15-16(6-12)28-10-27-15/h2-7H,8-10H2,1H3,(H,21,25)(H,22,23)