[4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]phenyl]methylazanium Openeye Name: [4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]phenyl]methylammonium CAS Name: [4-[2-oxo-2-(2-pyrimidinylamino)ethoxy]phenyl]methylammonium IUPAC Name: [4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-(2-pyrimidylamino)ethoxy]benzyl]ammonium Formula: C13H15N4O2+ MolecularWeight: 259.2838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)COC2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)COC2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C13H14N4O2/c14-8-10-2-4-11(5-3-10)19-9-12(18)17-13-15-6-1-7-16-13/h1-7H,8-9,14H2,(H,15,16,17,18)/p+1