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(1-butanoyl-4-oxidanyl-piperidin-4-yl)methyl-phenethyl-azanium

(1-butanoyl-4-oxidanyl-piperidin-4-yl)methyl-phenethyl-azanium

Systemtic Name:(1-butanoyl-4-oxidanyl-piperidin-4-yl)methyl-phenethyl-azanium
Openeye Name:(1-butanoyl-4-hydroxy-4-piperidyl)methyl-phenethyl-ammonium
CAS Name:[4-hydroxy-1-(1-oxobutyl)-4-piperidinyl]methyl-phenethylammonium
IUPAC Name:(1-butanoyl-4-hydroxypiperidin-4-yl)methyl-phenethylazanium
Traditional Name:(1-butyryl-4-hydroxy-4-piperidyl)methyl-phenethyl-ammonium
Formula: C18H29N2O2+
MolecularWeight: 305.43506
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC(CC1)(C[NH2+]CCC2=CC=CC=C2)O


Isomeric SMILES

CCCC(=O)N1CCC(CC1)(C[NH2+]CCC2=CC=CC=C2)O


InChI

InChI=1S/C18H28N2O2/c1-2-6-17(21)20-13-10-18(22,11-14-20)15-19-12-9-16-7-4-3-5-8-16/h3-5,7-8,19,22H,2,6,9-15H2,1H3/p+1


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