2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-3-methyl-1-phenyl-butyl]ethanamide

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-3-methyl-1-phenyl-butyl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-3-methyl-1-phenyl-butyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(1R)-3-methyl-1-phenylbutyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-3-methyl-1-phenylbutyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-3-methyl-1-phenyl-butyl]acetamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)C[C@H](C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C25H33N3O2/c1-19(2)17-24(22-7-5-4-6-8-22)26-25(30)18-27-13-15-28(16-14-27)23-11-9-21(10-12-23)20(3)29/h4-12,19,24H,13-18H2,1-3H3,(H,26,30)/p+1/t24-/m1/s1