2-(4-tert-butylphenoxy)-1-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-tert-butylphenoxy)-1-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone Openeye Name: 2-(4-tert-butylphenoxy)-1-[4-(2-pyrrolidin-1-ium-1-ylethyl)-1-piperidyl]ethanone CAS Name: 2-(4-tert-butylphenoxy)-1-[4-[2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperidinyl]ethanone IUPAC Name: 2-(4-tert-butylphenoxy)-1-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone Traditional Name: 2-(4-tert-butylphenoxy)-1-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperidino]ethanone Formula: C23H37N2O2+ MolecularWeight: 373.55208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCC(CC2)CC[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCC(CC2)CC[NH+]3CCCC3

InChI

InChI=1S/C23H36N2O2/c1-23(2,3)20-6-8-21(9-7-20)27-18-22(26)25-16-11-19(12-17-25)10-15-24-13-4-5-14-24/h6-9,19H,4-5,10-18H2,1-3H3/p+1