(3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one

Systemtic Name: (3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one Openeye Name: (3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one CAS Name: (3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one IUPAC Name: (3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one Traditional Name: (3aS,7aS)-3,3,5-trimethyl-7-phenyl-3a,7a-dihydropyrazolo[3,4-d]pyridazin-4-one Formula: C14H16N4O MolecularWeight: 256.30304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C(C(=NN(C2=O)C)C3=CC=CC=C3)N=N1)C

Isomeric SMILES

CC1([C@@H]2[C@@H](C(=NN(C2=O)C)C3=CC=CC=C3)N=N1)C

InChI

InChI=1S/C14H16N4O/c1-14(2)10-12(15-17-14)11(16-18(3)13(10)19)9-7-5-4-6-8-9/h4-8,10,12H,1-3H3/t10-,12+/m1/s1