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

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-benzyl-2-oxo-propyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(2R)-3-oxo-1-phenylbutan-2-yl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(2R)-3-oxo-1-phenylbutan-2-yl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-benzyl-2-keto-propyl]acetamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC(CC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N[C@H](CC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C24H29N3O3/c1-18(28)21-8-10-22(11-9-21)27-14-12-26(13-15-27)17-24(30)25-23(19(2)29)16-20-6-4-3-5-7-20/h3-11,23H,12-17H2,1-2H3,(H,25,30)/p+1/t23-/m1/s1