sodium 2-oxidanyl-3-phenylazanyl-propane-1-sulfonate

Systemtic Name: sodium 2-oxidanyl-3-phenylazanyl-propane-1-sulfonate Openeye Name: sodium 3-anilino-2-hydroxy-propane-1-sulfonate CAS Name: sodium 3-anilino-2-hydroxy-1-propanesulfonate IUPAC Name: sodium 3-anilino-2-hydroxypropane-1-sulfonate Traditional Name: sodium 3-anilino-2-hydroxy-propane-1-sulfonate Formula: C9H12NNaO4S MolecularWeight: 253.25065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO4S.Na/c11-9(7-15(12,13)14)6-10-8-4-2-1-3-5-8;/h1-5,9-11H,6-7H2,(H,12,13,14);/q;+1/p-1