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

Systemtic Name: 4-chloranyl-N-[2-[6-(4-methoxyphenyl)pyridazin-3-yl]oxyethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[6-(4-methoxyphenyl)pyridazin-3-yl]oxyethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[[6-(4-methoxyphenyl)-3-pyridazinyl]oxy]ethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[6-(4-methoxyphenyl)pyridazin-3-yl]oxyethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[6-(4-methoxyphenyl)pyridazin-3-yl]oxyethyl]-3-nitro-benzamide Formula: C20H17ClN4O5 MolecularWeight: 428.82578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN4O5/c1-29-15-5-2-13(3-6-15)17-8-9-19(24-23-17)30-11-10-22-20(26)14-4-7-16(21)18(12-14)25(27)28/h2-9,12H,10-11H2,1H3,(H,22,26)