N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[3-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide Formula: C20H24ClN4O4+ MolecularWeight: 419.88196

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4/c1-2-23-10-12-24(13-11-23)20-17(21)4-3-5-18(20)22-19(26)14-29-16-8-6-15(7-9-16)25(27)28/h3-9H,2,10-14H2,1H3,(H,22,26)/p+1