4-chloranyl-N-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]ethyl]-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(=O)C=C2)CCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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