2-chloranyl-N-[2-[6-(4-ethoxyphenyl)pyridazin-3-yl]oxyethyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-[6-(4-ethoxyphenyl)pyridazin-3-yl]oxyethyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-[6-(4-ethoxyphenyl)pyridazin-3-yl]oxyethyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-[[6-(4-ethoxyphenyl)-3-pyridazinyl]oxy]ethyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-[6-(4-ethoxyphenyl)pyridazin-3-yl]oxyethyl]-5-nitrobenzamide Traditional Name: 2-chloro-5-nitro-N-[2-(6-p-phenetylpyridazin-3-yl)oxyethyl]benzamide Formula: C21H19ClN4O5 MolecularWeight: 442.85236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H19ClN4O5/c1-2-30-16-6-3-14(4-7-16)19-9-10-20(25-24-19)31-12-11-23-21(27)17-13-15(26(28)29)5-8-18(17)22/h3-10,13H,2,11-12H2,1H3,(H,23,27)