[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]-2-propenoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]acrylic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C25H18F3N3O5 MolecularWeight: 497.42273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=CC(=O)OCC(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=CC(=O)OCC(=O)NCC(F)(F)F

InChI

InChI=1S/C25H18F3N3O5/c26-25(27,28)15-29-21(32)14-35-22(33)11-10-17-13-31(18-7-2-1-3-8-18)30-23(17)19-12-16-6-4-5-9-20(16)36-24(19)34/h1-13H,14-15H2,(H,29,32)