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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenoxy)acetamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4/c1-2-22-11-13-23(14-12-22)17-9-7-16(8-10-17)21-20(25)15-28-19-6-4-3-5-18(19)24(26)27/h3-10H,2,11-15H2,1H3,(H,21,25)/p+1