[4-[2-[(4-azanylpyrimidin-2-yl)amino]ethyl]phenyl] dihydrogen phosphate

Systemtic Name: [4-[2-[(4-azanylpyrimidin-2-yl)amino]ethyl]phenyl] dihydrogen phosphate Openeye Name: [4-[2-[(4-aminopyrimidin-2-yl)amino]ethyl]phenyl] dihydrogen phosphate CAS Name: [4-[2-[(4-amino-2-pyrimidinyl)amino]ethyl]phenyl] dihydrogen phosphate IUPAC Name: [4-[2-[(4-aminopyrimidin-2-yl)amino]ethyl]phenyl] dihydrogen phosphate Traditional Name: [4-[2-[(4-aminopyrimidin-2-yl)amino]ethyl]phenyl] dihydrogen phosphate Formula: C12H15N4O4P MolecularWeight: 310.245661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=NC=CC(=N2)N)OP(=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC2=NC=CC(=N2)N)OP(=O)(O)O

InChI

InChI=1S/C12H15N4O4P/c13-11-6-8-15-12(16-11)14-7-5-9-1-3-10(4-2-9)20-21(17,18)19/h1-4,6,8H,5,7H2,(H2,17,18,19)(H3,13,14,15,16)