2-oxidanylethanesulfonate; quinolin-1-ium

Systemtic Name: 2-oxidanylethanesulfonate; quinolin-1-ium Openeye Name: 2-hydroxyethanesulfonate; quinolin-1-ium CAS Name: 2-hydroxyethanesulfonate; quinolin-1-ium IUPAC Name: 2-hydroxyethanesulfonate; quinolin-1-ium Traditional Name: 2-hydroxyethanesulfonate; quinolin-1-ium Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[NH+]2.C(CS(=O)(=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[NH+]2.C(CS(=O)(=O)[O-])O

InChI

InChI=1S/C9H7N.C2H6O4S/c1-2-6-9-8(4-1)5-3-7-10-9;3-1-2-7(4,5)6/h1-7H;3H,1-2H2,(H,4,5,6)