[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C22H18FN3O4 MolecularWeight: 407.394423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN3O4/c1-13-19(25-30-21(13)14-7-9-15(23)10-8-14)12-29-20(27)11-18-16-5-3-4-6-17(16)22(28)26(2)24-18/h3-10H,11-12H2,1-2H3