2-(4-tert-butylphenoxy)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C24H33N2O2+ MolecularWeight: 381.53102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

InChI

InChI=1S/C24H32N2O2/c1-24(2,3)21-10-12-22(13-11-21)28-18-23(27)25-16-19-8-4-5-9-20(19)17-26-14-6-7-15-26/h4-5,8-13H,6-7,14-18H2,1-3H3,(H,25,27)/p+1