(2R)-1-[(2S)-2-methylpiperidin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: (2R)-1-[(2S)-2-methylpiperidin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol Openeye Name: (2R)-1-(4-isopropylphenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[(2S)-2-methyl-1-piperidin-1-iumyl]-3-(4-propan-2-ylphenoxy)-2-propanol IUPAC Name: (2R)-1-[(2S)-2-methylpiperidin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol Traditional Name: (2R)-1-(4-isopropylphenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(COC2=CC=C(C=C2)C(C)C)O

Isomeric SMILES

C[C@H]1CCCC[NH+]1C[C@H](COC2=CC=C(C=C2)C(C)C)O

InChI

InChI=1S/C18H29NO2/c1-14(2)16-7-9-18(10-8-16)21-13-17(20)12-19-11-5-4-6-15(19)3/h7-10,14-15,17,20H,4-6,11-13H2,1-3H3/p+1/t15-,17+/m0/s1