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(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium

(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium

Systemtic Name:(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium
Openeye Name:(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium
CAS Name:(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium
IUPAC Name:(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium
Traditional Name:(3S)-1-(1H-imidazol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium
Formula: C18H26N3O+
MolecularWeight: 300.41854
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC2CCC[NH+](C2)CC3=CN=CN3


Isomeric SMILES

COC1=CC=CC(=C1)CC[C@H]2CCC[NH+](C2)CC3=CN=CN3


InChI

InChI=1S/C18H25N3O/c1-22-18-6-2-4-15(10-18)7-8-16-5-3-9-21(12-16)13-17-11-19-14-20-17/h2,4,6,10-11,14,16H,3,5,7-9,12-13H2,1H3,(H,19,20)/p+1/t16-/m1/s1


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