1-(4-tert-butylphenyl)-2-[4-[(4-chlorophenyl)methyl]pyridin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-[4-[(4-chlorophenyl)methyl]pyridin-1-ium-1-yl]ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-[4-[(4-chlorophenyl)methyl]pyridin-1-ium-1-yl]ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[4-[(4-chlorophenyl)methyl]-1-pyridin-1-iumyl]ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-[4-[(4-chlorophenyl)methyl]pyridin-1-ium-1-yl]ethanone Traditional Name: 1-(4-tert-butylphenyl)-2-[4-(4-chlorobenzyl)pyridin-1-ium-1-yl]ethanone Formula: C24H25ClNO+ MolecularWeight: 378.9144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H25ClNO/c1-24(2,3)21-8-6-20(7-9-21)23(27)17-26-14-12-19(13-15-26)16-18-4-10-22(25)11-5-18/h4-15H,16-17H2,1-3H3/q+1