(3-chlorophenyl)-[(3S)-1-methylpiperidin-1-ium-3-yl]methanone

Systemtic Name: (3-chlorophenyl)-[(3S)-1-methylpiperidin-1-ium-3-yl]methanone Openeye Name: (3-chlorophenyl)-[(3S)-1-methylpiperidin-1-ium-3-yl]methanone CAS Name: (3-chlorophenyl)-[(3S)-1-methyl-3-piperidin-1-iumyl]methanone IUPAC Name: (3-chlorophenyl)-[(3S)-1-methylpiperidin-1-ium-3-yl]methanone Traditional Name: (3-chlorophenyl)-[(3S)-1-methylpiperidin-1-ium-3-yl]methanone Formula: C13H17ClNO+ MolecularWeight: 238.73318

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)C(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)C(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H16ClNO/c1-15-7-3-5-11(9-15)13(16)10-4-2-6-12(14)8-10/h2,4,6,8,11H,3,5,7,9H2,1H3/p+1/t11-/m0/s1