(1-phenylpyrazol-4-yl)methyl 4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: (1-phenylpyrazol-4-yl)methyl 4-[2-(4-fluoroanilino)-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-(4-fluoroanilino)-2-oxoethoxy]-3-methoxybenzoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 4-[2-(4-fluoroanilino)-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-(4-fluoroanilino)-2-keto-ethoxy]-3-methoxy-benzoic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C26H22FN3O5 MolecularWeight: 475.468383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=CN(N=C2)C3=CC=CC=C3)OCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=CN(N=C2)C3=CC=CC=C3)OCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN3O5/c1-33-24-13-19(7-12-23(24)34-17-25(31)29-21-10-8-20(27)9-11-21)26(32)35-16-18-14-28-30(15-18)22-5-3-2-4-6-22/h2-15H,16-17H2,1H3,(H,29,31)