2-chloranyl-3-(4-methylphenyl)quinolin-1-ium; hydrogen sulfate

Systemtic Name: 2-chloranyl-3-(4-methylphenyl)quinolin-1-ium; hydrogen sulfate Openeye Name: 2-chloro-3-(p-tolyl)quinolin-1-ium; hydrogen sulfate CAS Name: 2-chloro-3-(4-methylphenyl)quinolin-1-ium; hydrogen sulfate IUPAC Name: 2-chloro-3-(4-methylphenyl)quinolin-1-ium; hydrogen sulfate Traditional Name: 2-chloro-3-(p-tolyl)quinolin-1-ium bisulfate Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=CC=CC=C3[NH+]=C2Cl.OS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=CC=CC=C3[NH+]=C2Cl.OS(=O)(=O)[O-]

InChI

InChI=1S/C16H12ClN.H2O4S/c1-11-6-8-12(9-7-11)14-10-13-4-2-3-5-15(13)18-16(14)17;1-5(2,3)4/h2-10H,1H3;(H2,1,2,3,4)