(2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethyl-piperidin-1-ium

Systemtic Name: (2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethyl-piperidin-1-ium Openeye Name: (2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethyl-piperidin-1-ium CAS Name: (2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethylpiperidin-1-ium IUPAC Name: (2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethylpiperidin-1-ium Traditional Name: (2S,5S)-5-(3-methoxyphenyl)-2,5-dimethyl-1-phenethyl-piperidin-1-ium Formula: C22H30NO+ MolecularWeight: 324.4797

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH+]1CCC2=CC=CC=C2)(C)C3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H]1CC[C@@](C[NH+]1CCC2=CC=CC=C2)(C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H29NO/c1-18-12-14-22(2,20-10-7-11-21(16-20)24-3)17-23(18)15-13-19-8-5-4-6-9-19/h4-11,16,18H,12-15,17H2,1-3H3/p+1/t18-,22+/m0/s1