1-ethyl-7-methyl-quinolin-1-ium-2-sulfonic acid

Systemtic Name: 1-ethyl-7-methyl-quinolin-1-ium-2-sulfonic acid Openeye Name: 1-ethyl-7-methyl-quinolin-1-ium-2-sulfonic acid CAS Name: 1-ethyl-7-methyl-2-quinolin-1-iumsulfonic acid IUPAC Name: 1-ethyl-7-methylquinolin-1-ium-2-sulfonic acid Traditional Name: 1-ethyl-7-methyl-quinolin-1-ium-2-sulfonic acid Formula: C12H14NO3S+ MolecularWeight: 252.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC2=C1C=C(C=C2)C)S(=O)(=O)O

Isomeric SMILES

CC[N+]1=C(C=CC2=C1C=C(C=C2)C)S(=O)(=O)O

InChI

InChI=1S/C12H13NO3S/c1-3-13-11-8-9(2)4-5-10(11)6-7-12(13)17(14,15)16/h4-8H,3H2,1-2H3/p+1