4-[(3S)-5-methyl-3-oxidanyl-1-piperidin-1-ium-1-yl-hexan-3-yl]phenol

Systemtic Name: 4-[(3S)-5-methyl-3-oxidanyl-1-piperidin-1-ium-1-yl-hexan-3-yl]phenol Openeye Name: 4-[(1S)-1-hydroxy-3-methyl-1-(2-piperidin-1-ium-1-ylethyl)butyl]phenol CAS Name: 4-[(3S)-3-hydroxy-5-methyl-1-(1-piperidin-1-iumyl)hexan-3-yl]phenol IUPAC Name: 4-[(3S)-3-hydroxy-5-methyl-1-piperidin-1-ium-1-ylhexan-3-yl]phenol Traditional Name: 4-[(1S)-1-hydroxy-3-methyl-1-(2-piperidin-1-ium-1-ylethyl)butyl]phenol Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC[NH+]1CCCCC1)(C2=CC=C(C=C2)O)O

Isomeric SMILES

CC(C)C[C@](CC[NH+]1CCCCC1)(C2=CC=C(C=C2)O)O

InChI

InChI=1S/C18H29NO2/c1-15(2)14-18(21,16-6-8-17(20)9-7-16)10-13-19-11-4-3-5-12-19/h6-9,15,20-21H,3-5,10-14H2,1-2H3/p+1/t18-/m1/s1