N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-[4-(phenylcarbonyl)phenoxy]ethanamide

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-[4-(phenylcarbonyl)phenoxy]ethanamide Openeye Name: 2-(4-benzoylphenoxy)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(4-benzoylphenoxy)-N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-benzoylphenoxy)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(4-benzoylphenoxy)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide Formula: C28H31N2O4+ MolecularWeight: 459.55674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C28H30N2O4/c1-33-25-11-7-10-23(18-25)26(30-16-5-6-17-30)19-29-27(31)20-34-24-14-12-22(13-15-24)28(32)21-8-3-2-4-9-21/h2-4,7-15,18,26H,5-6,16-17,19-20H2,1H3,(H,29,31)/p+1/t26-/m0/s1