3-[2-(4-chlorophenyl)-7-methyl-pyrazolo[3,4-d]pyridazin-4-yl]chromen-2-one

Systemtic Name: 3-[2-(4-chlorophenyl)-7-methyl-pyrazolo[3,4-d]pyridazin-4-yl]chromen-2-one Openeye Name: 3-[2-(4-chlorophenyl)-7-methyl-pyrazolo[3,4-d]pyridazin-4-yl]chromen-2-one CAS Name: 3-[2-(4-chlorophenyl)-7-methyl-4-pyrazolo[3,4-d]pyridazinyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(4-chlorophenyl)-7-methylpyrazolo[3,4-d]pyridazin-4-yl]chromen-2-one Traditional Name: 3-[2-(4-chlorophenyl)-7-methyl-pyrazolo[3,4-d]pyridazin-4-yl]coumarin Formula: C21H13ClN4O2 MolecularWeight: 388.80652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CN(N=C12)C3=CC=C(C=C3)Cl)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=NN=C(C2=CN(N=C12)C3=CC=C(C=C3)Cl)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C21H13ClN4O2/c1-12-19-17(11-26(25-19)15-8-6-14(22)7-9-15)20(24-23-12)16-10-13-4-2-3-5-18(13)28-21(16)27/h2-11H,1H3