(3S,5S)-1-[3-(4-chloranylphenoxy)propyl]-3,5-dimethyl-piperidin-1-ium

Systemtic Name: (3S,5S)-1-[3-(4-chloranylphenoxy)propyl]-3,5-dimethyl-piperidin-1-ium Openeye Name: (3S,5S)-1-[3-(4-chlorophenoxy)propyl]-3,5-dimethyl-piperidin-1-ium CAS Name: (3S,5S)-1-[3-(4-chlorophenoxy)propyl]-3,5-dimethylpiperidin-1-ium IUPAC Name: (3S,5S)-1-[3-(4-chlorophenoxy)propyl]-3,5-dimethylpiperidin-1-ium Traditional Name: (3S,5S)-1-[3-(4-chlorophenoxy)propyl]-3,5-dimethyl-piperidin-1-ium Formula: C16H25ClNO+ MolecularWeight: 282.8288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCOC2=CC=C(C=C2)Cl)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CCCOC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H24ClNO/c1-13-10-14(2)12-18(11-13)8-3-9-19-16-6-4-15(17)5-7-16/h4-7,13-14H,3,8-12H2,1-2H3/p+1/t13-,14-/m0/s1