sodium [3-azanyl-4-(2-oxidanylpropoxy)phenyl]arsonic acid

Systemtic Name: sodium [3-azanyl-4-(2-oxidanylpropoxy)phenyl]arsonic acid Openeye Name: sodium [3-amino-4-(2-hydroxypropoxy)phenyl]arsonic acid CAS Name: sodium [3-amino-4-(2-hydroxypropoxy)phenyl]arsonic acid IUPAC Name: sodium [3-amino-4-(2-hydroxypropoxy)phenyl]arsonic acid Traditional Name: sodium [3-amino-4-(2-hydroxypropoxy)phenyl]arsonic acid Formula: C9H14AsNNaO5+ MolecularWeight: 314.12253

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=C(C=C1)[As](=O)(O)O)N)O.[Na+]

Isomeric SMILES

CC(COC1=C(C=C(C=C1)[As](=O)(O)O)N)O.[Na+]

InChI

InChI=1S/C9H14AsNO5.Na/c1-6(12)5-16-9-3-2-7(4-8(9)11)10(13,14)15;/h2-4,6,12H,5,11H2,1H3,(H2,13,14,15);/q;+1