sodium; 3-[9-(2-carboxyethyl)fluoren-9-yl]propanoate; sulfuric acid

Systemtic Name: sodium; 3-[9-(2-carboxyethyl)fluoren-9-yl]propanoate; sulfuric acid Openeye Name: sodium; 3-[9-(2-carboxyethyl)fluoren-9-yl]propanoate; sulfuric acid CAS Name: sodium; 3-[9-(2-carboxyethyl)-9-fluorenyl]propanoate; sulfuric acid IUPAC Name: sodium; 3-[9-(2-carboxyethyl)fluoren-9-yl]propanoate; sulfuric acid Traditional Name: sodium; 3-[9-(2-carboxyethyl)fluoren-9-yl]propionate; sulfuric acid Formula: C19H19NaO8S MolecularWeight: 430.40413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3C2(CCC(=O)O)CCC(=O)[O-].OS(=O)(=O)O.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C2(CCC(=O)O)CCC(=O)[O-].OS(=O)(=O)O.[Na+]

InChI

InChI=1S/C19H18O4.Na.H2O4S/c20-17(21)9-11-19(12-10-18(22)23)15-7-3-1-5-13(15)14-6-2-4-8-16(14)19;;1-5(2,3)4/h1-8H,9-12H2,(H,20,21)(H,22,23);;(H2,1,2,3,4)/q;+1;/p-1