methyl-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamic acid

Systemtic Name: methyl-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamic acid Openeye Name: methyl-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamic acid CAS Name: methyl-[4-[4-(4-morpholinyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]carbamic acid IUPAC Name: methyl-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamic acid Traditional Name: methyl-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamic acid Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C2=NC3=C(C=NN3)C(=N2)N4CCOCC4)C(=O)O

Isomeric SMILES

CN(C1=CC=C(C=C1)C2=NC3=C(C=NN3)C(=N2)N4CCOCC4)C(=O)O

InChI

InChI=1S/C17H18N6O3/c1-22(17(24)25)12-4-2-11(3-5-12)14-19-15-13(10-18-21-15)16(20-14)23-6-8-26-9-7-23/h2-5,10H,6-9H2,1H3,(H,24,25)(H,18,19,20,21)