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

Systemtic Name: (2R)-2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(4-chloro-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide CAS Name: (2R)-2-[4-(4-chloro-2-nitrophenyl)-1-piperazin-1-iumyl]-N,N-dimethyl-2-phenylacetamide IUPAC Name: (2R)-2-[4-(4-chloro-2-nitrophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenylacetamide Traditional Name: (2R)-2-[4-(4-chloro-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide Formula: C20H24ClN4O3+ MolecularWeight: 403.88256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN4O3/c1-22(2)20(26)19(15-6-4-3-5-7-15)24-12-10-23(11-13-24)17-9-8-16(21)14-18(17)25(27)28/h3-9,14,19H,10-13H2,1-2H3/p+1/t19-/m1/s1