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

Systemtic Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenoxy-ethanamide Openeye Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenoxy-acetamide CAS Name: N-[(2R)-2-(4-tert-butylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-phenoxyacetamide IUPAC Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-phenoxyacetamide Traditional Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenoxy-acetamide Formula: C24H33N2O2+ MolecularWeight: 381.53102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CNC(=O)COC2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C24H32N2O2/c1-24(2,3)20-13-11-19(12-14-20)22(26-15-7-8-16-26)17-25-23(27)18-28-21-9-5-4-6-10-21/h4-6,9-14,22H,7-8,15-18H2,1-3H3,(H,25,27)/p+1/t22-/m0/s1