(3S)-1-[[3-(4-chloranylphenoxy)phenyl]methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[[3-(4-chloranylphenoxy)phenyl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[[3-(4-chlorophenoxy)phenyl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[[3-(4-chlorophenoxy)phenyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[[3-(4-chlorophenoxy)phenyl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[3-(4-chlorophenoxy)benzyl]piperidin-1-ium-3-carboxamide Formula: C19H22ClN2O2+ MolecularWeight: 345.84318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)OC3=CC=C(C=C3)Cl)C(=O)N

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC(=CC=C2)OC3=CC=C(C=C3)Cl)C(=O)N

InChI

InChI=1S/C19H21ClN2O2/c20-16-6-8-17(9-7-16)24-18-5-1-3-14(11-18)12-22-10-2-4-15(13-22)19(21)23/h1,3,5-9,11,15H,2,4,10,12-13H2,(H2,21,23)/p+1/t15-/m0/s1