(4-ethoxyphenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium

Systemtic Name: (4-ethoxyphenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Openeye Name: (4-ethoxyphenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium CAS Name: (4-ethoxyphenyl)methyl-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Traditional Name: (4-ethoxybenzyl)-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2C

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C18H30N2O/c1-3-21-18-10-8-17(9-11-18)15-19-12-6-14-20-13-5-4-7-16(20)2/h8-11,16,19H,3-7,12-15H2,1-2H3/p+2/t16-/m0/s1