methyl 4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[1-(3-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C19H13ClN4O3 MolecularWeight: 380.78452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H13ClN4O3/c1-26-19(25)12-5-7-15(8-6-12)27-18-16-10-23-24(17(16)21-11-22-18)14-4-2-3-13(20)9-14/h2-11H,1H3