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

Systemtic Name: (4-ethoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Openeye Name: (4-ethoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)-1-piperidyl]methanone CAS Name: (4-ethoxyphenyl)-[(2S)-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperidinyl]methanone IUPAC Name: (4-ethoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Traditional Name: p-phenetyl-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidino]methanone Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2CCCCC2CC[NH+]3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2CCCC[C@H]2CC[NH+]3CCCC3

InChI

InChI=1S/C20H30N2O2/c1-2-24-19-10-8-17(9-11-19)20(23)22-15-4-3-7-18(22)12-16-21-13-5-6-14-21/h8-11,18H,2-7,12-16H2,1H3/p+1/t18-/m0/s1