4-[7-(3-chloranylphenoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl ethanoate

Systemtic Name: 4-[7-(3-chloranylphenoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl ethanoate Openeye Name: [3-[7-(3-chlorophenoxy)pyrazolo[1,5-a]pyrimidin-5-yl]-1-methyl-propyl] acetate CAS Name: acetic acid 4-[7-(3-chlorophenoxy)-5-pyrazolo[1,5-a]pyrimidinyl]butan-2-yl ester IUPAC Name: 4-[7-(3-chlorophenoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl acetate Traditional Name: acetic acid [3-[7-(3-chlorophenoxy)pyrazolo[1,5-a]pyrimidin-5-yl]-1-methyl-propyl] ester Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NC2=CC=NN2C(=C1)OC3=CC(=CC=C3)Cl)OC(=O)C

Isomeric SMILES

CC(CCC1=NC2=CC=NN2C(=C1)OC3=CC(=CC=C3)Cl)OC(=O)C

InChI

InChI=1S/C18H18ClN3O3/c1-12(24-13(2)23)6-7-15-11-18(22-17(21-15)8-9-20-22)25-16-5-3-4-14(19)10-16/h3-5,8-12H,6-7H2,1-2H3