sodium [4-[(2-azanylpyrimidin-4-yl)amino]phenyl]arsonic acid

Systemtic Name: sodium [4-[(2-azanylpyrimidin-4-yl)amino]phenyl]arsonic acid Openeye Name: sodium [4-[(2-aminopyrimidin-4-yl)amino]phenyl]arsonic acid CAS Name: sodium [4-[(2-amino-4-pyrimidinyl)amino]phenyl]arsonic acid IUPAC Name: sodium [4-[(2-aminopyrimidin-4-yl)amino]phenyl]arsonic acid Traditional Name: sodium [4-[(2-aminopyrimidin-4-yl)amino]phenyl]arsonic acid Formula: C10H11AsN4NaO3+ MolecularWeight: 333.13071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=NC=C2)N)[As](=O)(O)O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=NC=C2)N)[As](=O)(O)O.[Na+]

InChI

InChI=1S/C10H11AsN4O3.Na/c12-10-13-6-5-9(15-10)14-8-3-1-7(2-4-8)11(16,17)18;/h1-6H,(H2,16,17,18)(H3,12,13,14,15);/q;+1