(3S)-3-phenyl-1-piperidin-1-ium-1-yl-nonan-3-ol

Systemtic Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-nonan-3-ol Openeye Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-nonan-3-ol CAS Name: (3S)-3-phenyl-1-(1-piperidin-1-iumyl)-3-nonanol IUPAC Name: (3S)-3-phenyl-1-piperidin-1-ium-1-ylnonan-3-ol Traditional Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-nonan-3-ol Formula: C20H34NO+ MolecularWeight: 304.49006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33NO/c1-2-3-4-9-14-20(22,19-12-7-5-8-13-19)15-18-21-16-10-6-11-17-21/h5,7-8,12-13,22H,2-4,6,9-11,14-18H2,1H3/p+1/t20-/m0/s1