(4-fluorophenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate

Systemtic Name: (4-fluorophenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Openeye Name: (4-fluorophenyl)methyl 2-(2-methylindolin-1-yl)pyrimidine-5-carboperoxoate CAS Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboperoxoic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Traditional Name: 2-(2-methylindolin-1-yl)pyrimidine-5-carboperoxoic acid (4-fluorobenzyl) ester Formula: C21H18FN3O3 MolecularWeight: 379.384323

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)OOCC4=CC=C(C=C4)F

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)OOCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H18FN3O3/c1-14-10-16-4-2-3-5-19(16)25(14)21-23-11-17(12-24-21)20(26)28-27-13-15-6-8-18(22)9-7-15/h2-9,11-12,14H,10,13H2,1H3