[(1S)-2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C23H32ClN4O+ MolecularWeight: 415.97938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31ClN4O/c1-3-26(4-2)22(19-9-6-5-7-10-19)18-25-23(29)28-15-13-27(14-16-28)21-12-8-11-20(24)17-21/h5-12,17,22H,3-4,13-16,18H2,1-2H3,(H,25,29)/p+1/t22-/m1/s1