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

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-(4-o-phenetylpiperazin-1-ium-1-yl)acetamide Formula: C20H24ClN4O4+ MolecularWeight: 419.88196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

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