sodium 3-(3-methanoylphenoxy)propane-1-sulfonate

Systemtic Name: sodium 3-(3-methanoylphenoxy)propane-1-sulfonate Openeye Name: sodium 3-(3-formylphenoxy)propane-1-sulfonate CAS Name: sodium 3-(3-formylphenoxy)-1-propanesulfonate IUPAC Name: sodium 3-(3-formylphenoxy)propane-1-sulfonate Traditional Name: sodium 3-(3-formylphenoxy)propane-1-sulfonate Formula: C10H11NaO5S MolecularWeight: 266.24611

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCS(=O)(=O)[O-])C=O.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)OCCCS(=O)(=O)[O-])C=O.[Na+]

InChI

InChI=1S/C10H12O5S.Na/c11-8-9-3-1-4-10(7-9)15-5-2-6-16(12,13)14;/h1,3-4,7-8H,2,5-6H2,(H,12,13,14);/q;+1/p-1