2-[5-[(4-methylphenyl)methyl]-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium

Systemtic Name: 2-[5-[(4-methylphenyl)methyl]-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium Openeye Name: 2-[4-oxo-5-(p-tolylmethyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium CAS Name: 2-[5-[(4-methylphenyl)methyl]-4-oxo-1-pyrazolo[3,4-d]pyrimidinyl]ethylammonium IUPAC Name: 2-[5-[(4-methylphenyl)methyl]-4-oxopyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium Traditional Name: 2-[4-keto-5-(4-methylbenzyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium Formula: C15H18N5O+ MolecularWeight: 284.33632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=NN3CC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=NN3CC[NH3+]

InChI

InChI=1S/C15H17N5O/c1-11-2-4-12(5-3-11)9-19-10-17-14-13(15(19)21)8-18-20(14)7-6-16/h2-5,8,10H,6-7,9,16H2,1H3/p+1