(3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: (3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: (3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one CAS Name: (3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: (3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: (3R,3aS)-5-tert-butyl-3-phenyl-2,3,3a,4-tetrahydropyrrolo[3,4-c]pyrazol-6-one Formula: C15H19N3O MolecularWeight: 257.33086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC2C(NN=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C[C@H]2[C@@H](NN=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C15H19N3O/c1-15(2,3)18-9-11-12(10-7-5-4-6-8-10)16-17-13(11)14(18)19/h4-8,11-12,16H,9H2,1-3H3/t11-,12-/m0/s1