2-[4-[(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: 2-[4-[(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: 2-[4-[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: 2-[4-[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: 2-[4-[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: 2-[4-[(1S)-2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl]piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C[NH+]1CCN(CC1)C(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CNC(=O)C[NH+]1CCN(CC1)[C@@H](C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H26N4O2/c1-24-21(28)16-26-11-13-27(14-12-26)22(17-7-3-2-4-8-17)23(29)19-15-25-20-10-6-5-9-18(19)20/h2-10,15,22,25H,11-14,16H2,1H3,(H,24,28)/p+1/t22-/m0/s1