(2E)-1-ethyl-2-[(2-ethylisoquinolin-2-ium-1-yl)methylidene]quinoline chloride

Systemtic Name: (2E)-1-ethyl-2-[(2-ethylisoquinolin-2-ium-1-yl)methylidene]quinoline chloride Openeye Name: (2E)-1-ethyl-2-[(2-ethylisoquinolin-2-ium-1-yl)methylene]quinoline chloride CAS Name: (2E)-1-ethyl-2-[(2-ethyl-1-isoquinolin-2-iumyl)methylidene]quinoline chloride IUPAC Name: (2E)-1-ethyl-2-[(2-ethylisoquinolin-2-ium-1-yl)methylidene]quinoline chloride Traditional Name: (2E)-1-ethyl-2-[(2-ethylisoquinolin-2-ium-1-yl)methylene]quinoline chloride Formula: C23H23ClN2 MolecularWeight: 362.89512

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=[N+](C=CC3=CC=CC=C32)CC)C=CC4=CC=CC=C41.[Cl-]

Isomeric SMILES

CCN1/C(=C/C2=[N+](C=CC3=CC=CC=C32)CC)/C=CC4=CC=CC=C41.[Cl-]

InChI

InChI=1S/C23H23N2.ClH/c1-3-24-16-15-18-9-5-7-11-21(18)23(24)17-20-14-13-19-10-6-8-12-22(19)25(20)4-2;/h5-17H,3-4H2,1-2H3;1H/q+1;/p-1