(4-chlorophenyl)-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: (4-chlorophenyl)-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: (4-chlorophenyl)-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]methanone CAS Name: (4-chlorophenyl)-[(3S)-1-(2-pyridinylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: (4-chlorophenyl)-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone Traditional Name: (4-chlorophenyl)-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]methanone Formula: C18H20ClN2O+ MolecularWeight: 315.8172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2O/c19-16-8-6-14(7-9-16)18(22)15-4-3-11-21(12-15)13-17-5-1-2-10-20-17/h1-2,5-10,15H,3-4,11-13H2/p+1/t15-/m0/s1