1-(4-cyclohexylphenyl)-2-isoquinolin-2-ium-2-yl-ethanone

Systemtic Name: 1-(4-cyclohexylphenyl)-2-isoquinolin-2-ium-2-yl-ethanone Openeye Name: 1-(4-cyclohexylphenyl)-2-isoquinolin-2-ium-2-yl-ethanone CAS Name: 1-(4-cyclohexylphenyl)-2-(2-isoquinolin-2-iumyl)ethanone IUPAC Name: 1-(4-cyclohexylphenyl)-2-isoquinolin-2-ium-2-ylethanone Traditional Name: 1-(4-cyclohexylphenyl)-2-isoquinolin-2-ium-2-yl-ethanone Formula: C23H24NO+ MolecularWeight: 330.44276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C[N+]3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C[N+]3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H24NO/c25-23(17-24-15-14-19-8-4-5-9-22(19)16-24)21-12-10-20(11-13-21)18-6-2-1-3-7-18/h4-5,8-16,18H,1-3,6-7,17H2/q+1