(2-purin-9-yloxolan-3-yl) 2-[(3-fluoranyl-2-methyl-phenyl)amino]ethanoate

Systemtic Name: (2-purin-9-yloxolan-3-yl) 2-[(3-fluoranyl-2-methyl-phenyl)amino]ethanoate Openeye Name: (2-purin-9-yltetrahydrofuran-3-yl) 2-(3-fluoro-2-methyl-anilino)acetate CAS Name: 2-(3-fluoro-2-methylanilino)acetic acid [2-(9-purinyl)-3-oxolanyl] ester IUPAC Name: (2-purin-9-yloxolan-3-yl) 2-(3-fluoro-2-methylanilino)acetate Traditional Name: 2-(3-fluoro-2-methyl-anilino)acetic acid (2-purin-9-yltetrahydrofuran-3-yl) ester Formula: C18H18FN5O3 MolecularWeight: 371.365623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1F)NCC(=O)OC2CCOC2N3C=NC4=CN=CN=C43

Isomeric SMILES

CC1=C(C=CC=C1F)NCC(=O)OC2CCOC2N3C=NC4=CN=CN=C43

InChI

InChI=1S/C18H18FN5O3/c1-11-12(19)3-2-4-13(11)21-8-16(25)27-15-5-6-26-18(15)24-10-23-14-7-20-9-22-17(14)24/h2-4,7,9-10,15,18,21H,5-6,8H2,1H3