2,2,6,6-tetramethyl-1-[(2S)-3-(3-methyl-4-propan-2-yl-phenoxy)-2-oxidanyl-propyl]piperidin-1-ium-4-ol

Systemtic Name: 2,2,6,6-tetramethyl-1-[(2S)-3-(3-methyl-4-propan-2-yl-phenoxy)-2-oxidanyl-propyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2S)-2-hydroxy-3-(4-isopropyl-3-methyl-phenoxy)propyl]-2,2,6,6-tetramethyl-piperidin-1-ium-4-ol CAS Name: 1-[(2S)-2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]-2,2,6,6-tetramethyl-4-piperidin-1-iumol IUPAC Name: 1-[(2S)-2-hydroxy-3-(3-methyl-4-propan-2-ylphenoxy)propyl]-2,2,6,6-tetramethylpiperidin-1-ium-4-ol Traditional Name: 1-[(2S)-2-hydroxy-3-(4-isopropyl-3-methyl-phenoxy)propyl]-2,2,6,6-tetramethyl-piperidin-1-ium-4-ol Formula: C22H38NO3+ MolecularWeight: 364.54202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(C[NH+]2C(CC(CC2(C)C)O)(C)C)O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@H](C[NH+]2C(CC(CC2(C)C)O)(C)C)O)C(C)C

InChI

InChI=1S/C22H37NO3/c1-15(2)20-9-8-19(10-16(20)3)26-14-18(25)13-23-21(4,5)11-17(24)12-22(23,6)7/h8-10,15,17-18,24-25H,11-14H2,1-7H3/p+1/t18-/m0/s1