N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-nitro-2-furamide Formula: C17H20ClN4O4+ MolecularWeight: 379.8181

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN4O4/c1-2-20-8-10-21(11-9-20)16-12(18)4-3-5-13(16)19-17(23)14-6-7-15(26-14)22(24)25/h3-7H,2,8-11H2,1H3,(H,19,23)/p+1