1-[1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-3-yl]ethanone

Systemtic Name: 1-[1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-3-yl]ethanone Openeye Name: 1-[1-[(4-isopropylphenyl)methyl]pyridin-1-ium-3-yl]ethanone CAS Name: 1-[1-[(4-propan-2-ylphenyl)methyl]-3-pyridin-1-iumyl]ethanone IUPAC Name: 1-[1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-3-yl]ethanone Traditional Name: 1-[1-(4-isopropylbenzyl)pyridin-1-ium-3-yl]ethanone Formula: C17H20NO+ MolecularWeight: 254.3468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20NO/c1-13(2)16-8-6-15(7-9-16)11-18-10-4-5-17(12-18)14(3)19/h4-10,12-13H,11H2,1-3H3/q+1