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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenyl)acetamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenyl)acetamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-(2-nitrophenyl)acetamide Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-2-22-11-13-23(14-12-22)18-9-7-17(8-10-18)21-20(25)15-16-5-3-4-6-19(16)24(26)27/h3-10H,2,11-15H2,1H3,(H,21,25)/p+1