1,2-dimethyl-7-phenyl-isoquinolin-2-ium iodide

Systemtic Name: 1,2-dimethyl-7-phenyl-isoquinolin-2-ium iodide Openeye Name: 1,2-dimethyl-7-phenyl-isoquinolin-2-ium iodide CAS Name: 1,2-dimethyl-7-phenylisoquinolin-2-ium iodide IUPAC Name: 1,2-dimethyl-7-phenylisoquinolin-2-ium iodide Traditional Name: 1,2-dimethyl-7-phenyl-isoquinolin-2-ium iodide Formula: C17H16IN MolecularWeight: 361.22011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC2=C1C=C(C=C2)C3=CC=CC=C3)C.[I-]

Isomeric SMILES

CC1=[N+](C=CC2=C1C=C(C=C2)C3=CC=CC=C3)C.[I-]

InChI

InChI=1S/C17H16N.HI/c1-13-17-12-16(14-6-4-3-5-7-14)9-8-15(17)10-11-18(13)2;/h3-12H,1-2H3;1H/q+1;/p-1