5-[[6-azanylidene-3-(4-chlorophenyl)pyridazin-1-yl]methyl]-1,2-oxazol-3-one

Systemtic Name: 5-[[6-azanylidene-3-(4-chlorophenyl)pyridazin-1-yl]methyl]-1,2-oxazol-3-one Openeye Name: 5-[[3-(4-chlorophenyl)-6-imino-pyridazin-1-yl]methyl]isoxazol-3-one CAS Name: 5-[[3-(4-chlorophenyl)-6-imino-1-pyridazinyl]methyl]-3-isoxazolone IUPAC Name: 5-[[3-(4-chlorophenyl)-6-iminopyridazin-1-yl]methyl]-1,2-oxazol-3-one Traditional Name: 5-[[3-(4-chlorophenyl)-6-imino-pyridazin-1-yl]methyl]-4-isoxazolin-3-one Formula: C14H11ClN4O2 MolecularWeight: 302.71574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=N)C=C2)CC3=CC(=O)NO3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=N)C=C2)CC3=CC(=O)NO3)Cl

InChI

InChI=1S/C14H11ClN4O2/c15-10-3-1-9(2-4-10)12-5-6-13(16)19(17-12)8-11-7-14(20)18-21-11/h1-7,16H,8H2,(H,18,20)