N-(4-chloranyl-2-nitro-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-(4-p-anisylpiperazine-1,4-diium-1-yl)acetamide Formula: C20H25ClN4O4+2 MolecularWeight: 420.8899

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4/c1-29-17-5-2-15(3-6-17)13-23-8-10-24(11-9-23)14-20(26)22-18-7-4-16(21)12-19(18)25(27)28/h2-7,12H,8-11,13-14H2,1H3,(H,22,26)/p+2