4-methoxy-N-[(1S)-2,2,2-tris(chloranyl)-1-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-methoxy-N-[(1S)-2,2,2-tris(chloranyl)-1-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-methoxy-N-[(1S)-2,2,2-trichloro-1-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-methoxy-N-[(1S)-2,2,2-trichloro-1-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-methoxy-N-[(1S)-2,2,2-trichloro-1-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-methoxy-N-[(1S)-2,2,2-trichloro-1-piperidin-1-ium-1-yl-ethyl]benzamide Formula: C15H20Cl3N2O2+ MolecularWeight: 366.6905

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)[NH+]2CCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N[C@H](C(Cl)(Cl)Cl)[NH+]2CCCCC2

InChI

InChI=1S/C15H19Cl3N2O2/c1-22-12-7-5-11(6-8-12)13(21)19-14(15(16,17)18)20-9-3-2-4-10-20/h5-8,14H,2-4,9-10H2,1H3,(H,19,21)/p+1/t14-/m0/s1