4-chloranyl-1,2-dimethyl-quinolin-1-ium sulfate

Systemtic Name: 4-chloranyl-1,2-dimethyl-quinolin-1-ium sulfate Openeye Name: 4-chloro-1,2-dimethyl-quinolin-1-ium sulfate CAS Name: 4-chloro-1,2-dimethylquinolin-1-ium sulfate IUPAC Name: 4-chloro-1,2-dimethylquinolin-1-ium sulfate Traditional Name: 4-chloro-1,2-dimethyl-quinolin-1-ium sulfate Formula: C22H22Cl2N2O4S MolecularWeight: 481.39208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2C(=C1)Cl)C.CC1=[N+](C2=CC=CC=C2C(=C1)Cl)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2C(=C1)Cl)C.CC1=[N+](C2=CC=CC=C2C(=C1)Cl)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C11H11ClN.H2O4S/c2*1-8-7-10(12)9-5-3-4-6-11(9)13(8)2;1-5(2,3)4/h2*3-7H,1-2H3;(H2,1,2,3,4)/q2*+1;/p-2