(2S,4R,5S)-2,5-dimethyl-1-(3-methylbutyl)-4-phenyl-piperidin-1-ium-4-ol

Systemtic Name: (2S,4R,5S)-2,5-dimethyl-1-(3-methylbutyl)-4-phenyl-piperidin-1-ium-4-ol Openeye Name: (2S,4R,5S)-1-isopentyl-2,5-dimethyl-4-phenyl-piperidin-1-ium-4-ol CAS Name: (2S,4R,5S)-2,5-dimethyl-1-(3-methylbutyl)-4-phenyl-4-piperidin-1-iumol IUPAC Name: (2S,4R,5S)-2,5-dimethyl-1-(3-methylbutyl)-4-phenylpiperidin-1-ium-4-ol Traditional Name: (2S,4R,5S)-1-isoamyl-2,5-dimethyl-4-phenyl-piperidin-1-ium-4-ol Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C[NH+]1CCC(C)C)C)(C2=CC=CC=C2)O

Isomeric SMILES

C[C@H]1C[C@@]([C@H](C[NH+]1CCC(C)C)C)(C2=CC=CC=C2)O

InChI

InChI=1S/C18H29NO/c1-14(2)10-11-19-13-15(3)18(20,12-16(19)4)17-8-6-5-7-9-17/h5-9,14-16,20H,10-13H2,1-4H3/p+1/t15-,16-,18+/m0/s1