(2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N,N-dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)[C@@H](C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-21(2)20(25)19(16-6-4-3-5-7-16)23-14-12-22(13-15-23)17-8-10-18(11-9-17)24(26)27/h3-11,19H,12-15H2,1-2H3/p+1/t19-/m1/s1