N-[3-(1-methylpiperidin-1-ium-1-yl)propyl]-2-[3-(phenylcarbonyl)phenyl]propanamide iodide

Systemtic Name: N-[3-(1-methylpiperidin-1-ium-1-yl)propyl]-2-[3-(phenylcarbonyl)phenyl]propanamide iodide Openeye Name: 2-(3-benzoylphenyl)-N-[3-(1-methylpiperidin-1-ium-1-yl)propyl]propanamide iodide CAS Name: 2-(3-benzoylphenyl)-N-[3-(1-methyl-1-piperidin-1-iumyl)propyl]propanamide iodide IUPAC Name: 2-(3-benzoylphenyl)-N-[3-(1-methylpiperidin-1-ium-1-yl)propyl]propanamide iodide Traditional Name: 2-(3-benzoylphenyl)-N-[3-(1-methylpiperidin-1-ium-1-yl)propyl]propionamide iodide Formula: C25H33IN2O2 MolecularWeight: 520.44619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)NCCC[N+]3(CCCCC3)C.[I-]

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)NCCC[N+]3(CCCCC3)C.[I-]

InChI

InChI=1S/C25H32N2O2.HI/c1-20(25(29)26-15-10-18-27(2)16-7-4-8-17-27)22-13-9-14-23(19-22)24(28)21-11-5-3-6-12-21;/h3,5-6,9,11-14,19-20H,4,7-8,10,15-18H2,1-2H3;1H