(2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCN2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)OCCN2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H27N3O3/c1-26-18-7-9-19(10-8-18)27-16-15-23-11-13-24(14-12-23)20(21(22)25)17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3,(H2,22,25)/p+1/t20-/m1/s1