(2R)-2-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]-N-(4-methylphenyl)-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]-N-(4-methylphenyl)-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-2-phenyl-N-(p-tolyl)acetamide CAS Name: (2R)-2-[4-(4-ethyl-1-piperazin-4-iumyl)anilino]-N-(4-methylphenyl)-2-phenylacetamide IUPAC Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-N-(4-methylphenyl)-2-phenylacetamide Traditional Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-2-phenyl-N-(p-tolyl)acetamide Formula: C27H33N4O+ MolecularWeight: 429.57712

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)N[C@H](C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C27H32N4O/c1-3-30-17-19-31(20-18-30)25-15-13-23(14-16-25)28-26(22-7-5-4-6-8-22)27(32)29-24-11-9-21(2)10-12-24/h4-16,26,28H,3,17-20H2,1-2H3,(H,29,32)/p+1/t26-/m1/s1