azanium sodium 2-phenylbenzenesulfonate

Systemtic Name: azanium sodium 2-phenylbenzenesulfonate Openeye Name: ammonium sodium 2-phenylbenzenesulfonate CAS Name: ammonium sodium 2-phenylbenzenesulfonate IUPAC Name: azanium sodium 2-phenylbenzenesulfonate Traditional Name: ammonium sodium 2-phenylbesylate Formula: C24H22NNaO6S2 MolecularWeight: 507.55435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[Na+]

InChI

InChI=1S/2C12H10O3S.H3N.Na/c2*13-16(14,15)12-9-5-4-8-11(12)10-6-2-1-3-7-10;;/h2*1-9H,(H,13,14,15);1H3;/q;;;+1/p-1