[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] 3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] 3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl] 3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: 3-(5-bromo-2-fluorophenyl)-2-propenoic acid [1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] 3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: 3-(5-bromo-2-fluoro-phenyl)acrylic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H15BrFNO5 MolecularWeight: 436.228503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C=CC3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C19H15BrFNO5/c1-11(19(24)22-14-4-6-16-17(9-14)26-10-25-16)27-18(23)7-2-12-8-13(20)3-5-15(12)21/h2-9,11H,10H2,1H3,(H,22,24)