(phenylmethyl) 2-(4-methyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanoate

Systemtic Name: (phenylmethyl) 2-(4-methyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanoate Openeye Name: benzyl 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetate CAS Name: 2-(4-methyl-7-oxo-1-phenyl-6-pyrazolo[3,4-d]pyridazinyl)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-methyl-7-oxo-1-phenylpyrazolo[3,4-d]pyridazin-6-yl)acetate Traditional Name: 2-(7-keto-4-methyl-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetic acid benzyl ester Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1C=NN2C3=CC=CC=C3)CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C2=C1C=NN2C3=CC=CC=C3)CC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3/c1-15-18-12-22-25(17-10-6-3-7-11-17)20(18)21(27)24(23-15)13-19(26)28-14-16-8-4-2-5-9-16/h2-12H,13-14H2,1H3