sodium 2-phenoxy-3-sulfonato-terephthalate

Systemtic Name: sodium 2-phenoxy-3-sulfonato-terephthalate Openeye Name: sodium 2-phenoxy-3-sulfonato-terephthalate CAS Name: sodium 2-phenoxy-3-sulfonatoterephthalate IUPAC Name: sodium 2-phenoxy-3-sulfonatoterephthalate Traditional Name: sodium 2-phenoxy-3-sulfonato-terephthalate Formula: C14H7NaO8S-2 MolecularWeight: 358.25535

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+]

InChI

InChI=1S/C14H10O8S.Na/c15-13(16)9-6-7-10(14(17)18)12(23(19,20)21)11(9)22-8-4-2-1-3-5-8;/h1-7H,(H,15,16)(H,17,18)(H,19,20,21);/q;+1/p-3