N,N-dimethyl-2-(1-phenylquinolin-1-ium-2-yl)sulfanyl-ethanamine chloride

Systemtic Name: N,N-dimethyl-2-(1-phenylquinolin-1-ium-2-yl)sulfanyl-ethanamine chloride Openeye Name: N,N-dimethyl-2-(1-phenylquinolin-1-ium-2-yl)sulfanyl-ethanamine chloride CAS Name: N,N-dimethyl-2-[(1-phenyl-2-quinolin-1-iumyl)thio]ethanamine chloride IUPAC Name: N,N-dimethyl-2-(1-phenylquinolin-1-ium-2-yl)sulfanylethanamine chloride Traditional Name: dimethyl-[2-[(1-phenylquinolin-1-ium-2-yl)thio]ethyl]amine chloride Formula: C19H21ClN2S MolecularWeight: 344.90144

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=[N+](C2=CC=CC=C2C=C1)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CN(C)CCSC1=[N+](C2=CC=CC=C2C=C1)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C19H21N2S.ClH/c1-20(2)14-15-22-19-13-12-16-8-6-7-11-18(16)21(19)17-9-4-3-5-10-17;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1