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

Systemtic Name: (2-butoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Openeye Name: (2-butoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)-1-piperidyl]methanone CAS Name: (2-butoxyphenyl)-[(2S)-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperidinyl]methanone IUPAC Name: (2-butoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]methanone Traditional Name: (2-butoxyphenyl)-[(2S)-2-(2-pyrrolidin-1-ium-1-ylethyl)piperidino]methanone Formula: C22H35N2O2+ MolecularWeight: 359.5255

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)N2CCCCC2CC[NH+]3CCCC3

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)N2CCCC[C@H]2CC[NH+]3CCCC3

InChI

InChI=1S/C22H34N2O2/c1-2-3-18-26-21-12-5-4-11-20(21)22(25)24-16-7-6-10-19(24)13-17-23-14-8-9-15-23/h4-5,11-12,19H,2-3,6-10,13-18H2,1H3/p+1/t19-/m0/s1