(2R)-N-(4-chloranyl-3-nitro-phenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(4-chloranyl-3-nitro-phenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N-(4-chloro-3-nitro-phenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-(4-chloro-3-nitrophenyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N-(4-chloro-3-nitrophenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-(4-chloro-3-nitro-phenyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C23H22ClN4O5+ MolecularWeight: 469.89758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C23H21ClN4O5/c24-18-9-8-17(15-19(18)28(31)32)25-22(29)21(16-5-2-1-3-6-16)26-10-12-27(13-11-26)23(30)20-7-4-14-33-20/h1-9,14-15,21H,10-13H2,(H,25,29)/p+1/t21-/m1/s1