N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-ethanamide

Systemtic Name: N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-ethanamide Openeye Name: N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-acetamide CAS Name: N-[3-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]propyl]-2-phenoxyacetamide IUPAC Name: N-[3-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propyl]-2-phenoxyacetamide Traditional Name: N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CCCNC(=O)COC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)CCCNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2/c1-24-15-16-25(21(17-24)19-9-4-2-5-10-19)14-8-13-23-22(26)18-27-20-11-6-3-7-12-20/h2-7,9-12,21H,8,13-18H2,1H3,(H,23,26)/p+1/t21-/m1/s1