2-(3,6-disulfonaphthalen-2-yl)oxyethanoic acid

Systemtic Name: 2-(3,6-disulfonaphthalen-2-yl)oxyethanoic acid Openeye Name: 2-[(3,6-disulfo-2-naphthyl)oxy]acetic acid CAS Name: 2-[(3,6-disulfo-2-naphthalenyl)oxy]acetic acid IUPAC Name: 2-(3,6-disulfonaphthalen-2-yl)oxyacetic acid Traditional Name: 2-(3,6-disulfo-2-naphthoxy)acetic acid Formula: C12H10O9S2 MolecularWeight: 362.3324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=CC(=C(C=C21)OCC(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC2=CC(=C(C=C21)OCC(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C12H10O9S2/c13-12(14)6-21-10-4-7-1-2-9(22(15,16)17)3-8(7)5-11(10)23(18,19)20/h1-5H,6H2,(H,13,14)(H,15,16,17)(H,18,19,20)