N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[(2R)-2-(4-tert-butylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-methylphenoxy)acetamide Formula: C25H35N2O2+ MolecularWeight: 395.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NCC(C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC[C@@H](C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCC3

InChI

InChI=1S/C25H34N2O2/c1-19-8-7-9-22(16-19)29-18-24(28)26-17-23(27-14-5-6-15-27)20-10-12-21(13-11-20)25(2,3)4/h7-13,16,23H,5-6,14-15,17-18H2,1-4H3,(H,26,28)/p+1/t23-/m0/s1