(3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium

Systemtic Name: (3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium Openeye Name: (3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium CAS Name: (3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium IUPAC Name: (3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium Traditional Name: (3S,5S)-3,5-dimethyl-1-(4-phenoxybutyl)piperidin-1-ium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCCOC2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CCCCOC2=CC=CC=C2)C

InChI

InChI=1S/C17H27NO/c1-15-12-16(2)14-18(13-15)10-6-7-11-19-17-8-4-3-5-9-17/h3-5,8-9,15-16H,6-7,10-14H2,1-2H3/p+1/t15-,16-/m0/s1