2-methyl-5-[(2-nitrophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 2-methyl-5-[(2-nitrophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 2-methyl-5-[(2-nitrophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 2-methyl-5-[(2-nitrophenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 2-methyl-5-[(2-nitrophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 2-methyl-5-(2-nitrobenzyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C2C(=N1)N=CN(C2=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN1C=C2C(=N1)N=CN(C2=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O3/c1-16-7-10-12(15-16)14-8-17(13(10)19)6-9-4-2-3-5-11(9)18(20)21/h2-5,7-8H,6H2,1H3