[(1S)-2-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C25H35N4O2+ MolecularWeight: 423.571

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C25H34N4O2/c1-4-27(5-2)24(22-9-7-6-8-10-22)19-26-25(31)29-17-15-28(16-18-29)23-13-11-21(12-14-23)20(3)30/h6-14,24H,4-5,15-19H2,1-3H3,(H,26,31)/p+1/t24-/m1/s1