[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: [1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: [2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl] (E)-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-3-(4-propan-2-ylphenyl)-2-propenoic acid [1-(2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-fluoroanilino)-1-oxopropan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-3-p-cumenylacrylic acid [2-(2-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H22FNO3 MolecularWeight: 355.402683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)OC(C)C(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)OC(C)C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C21H22FNO3/c1-14(2)17-11-8-16(9-12-17)10-13-20(24)26-15(3)21(25)23-19-7-5-4-6-18(19)22/h4-15H,1-3H3,(H,23,25)/b13-10+