(4-ethoxyphenyl)-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]methanone

Systemtic Name: (4-ethoxyphenyl)-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Openeye Name: (4-ethoxyphenyl)-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)-1-piperidyl]methanone CAS Name: (4-ethoxyphenyl)-[(2S)-2-[2-(1-piperidin-1-iumyl)ethyl]-1-piperidinyl]methanone IUPAC Name: (4-ethoxyphenyl)-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Traditional Name: [(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidino]-p-phenetyl-methanone Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2CCCCC2CC[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2CCCC[C@H]2CC[NH+]3CCCCC3

InChI

InChI=1S/C21H32N2O2/c1-2-25-20-11-9-18(10-12-20)21(24)23-16-7-4-8-19(23)13-17-22-14-5-3-6-15-22/h9-12,19H,2-8,13-17H2,1H3/p+1/t19-/m0/s1