(2S)-2-(4-ethylpiperazin-1-ium-1-yl)-N-(4-methylphenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(4-ethylpiperazin-1-ium-1-yl)-N-(4-methylphenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-N-(p-tolyl)acetamide CAS Name: (2S)-2-(4-ethyl-1-piperazin-1-iumyl)-N-(4-methylphenyl)-2-phenylacetamide IUPAC Name: (2S)-2-(4-ethylpiperazin-1-ium-1-yl)-N-(4-methylphenyl)-2-phenylacetamide Traditional Name: (2S)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-N-(p-tolyl)acetamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCN1CC[NH+](CC1)[C@@H](C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H27N3O/c1-3-23-13-15-24(16-14-23)20(18-7-5-4-6-8-18)21(25)22-19-11-9-17(2)10-12-19/h4-12,20H,3,13-16H2,1-2H3,(H,22,25)/p+1/t20-/m0/s1