(3S)-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)nonan-3-ol

Systemtic Name: (3S)-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)nonan-3-ol Openeye Name: (3S)-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)nonan-3-ol CAS Name: (3S)-1-(1-piperidin-1-iumyl)-3-(4-propoxyphenyl)-3-nonanol IUPAC Name: (3S)-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)nonan-3-ol Traditional Name: (3S)-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)nonan-3-ol Formula: C23H40NO2+ MolecularWeight: 362.5692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H39NO2/c1-3-5-6-8-15-23(25,16-19-24-17-9-7-10-18-24)21-11-13-22(14-12-21)26-20-4-2/h11-14,25H,3-10,15-20H2,1-2H3/p+1/t23-/m0/s1