2-[[4-[(4-nitrophenyl)methylamino]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol

Systemtic Name: 2-[[4-[(4-nitrophenyl)methylamino]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Openeye Name: 2-[[1-isopropyl-4-[(4-nitrophenyl)methylamino]pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol CAS Name: 2-[[4-[(4-nitrophenyl)methylamino]-1-propan-2-yl-6-pyrazolo[3,4-d]pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-[(4-nitrophenyl)methylamino]-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Traditional Name: 2-[[1-isopropyl-4-[(4-nitrobenzyl)amino]pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Formula: C17H21N7O3 MolecularWeight: 371.39374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=NC(=N2)NCCO)NCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=NC(=N2)NCCO)NCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N7O3/c1-11(2)23-16-14(10-20-23)15(21-17(22-16)18-7-8-25)19-9-12-3-5-13(6-4-12)24(26)27/h3-6,10-11,25H,7-9H2,1-2H3,(H2,18,19,21,22)