5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6-dione

Systemtic Name: 5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6-dione Openeye Name: 5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazole-4,6-dione CAS Name: 5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazole-4,6-dione IUPAC Name: 5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazole-4,6-dione Traditional Name: 5-cyclohexyl-3-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazole-4,6-quinone Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3C(C2=O)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3C(C2=O)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C16H18N4O2/c21-15-13-14(16(22)19(15)11-7-3-1-4-8-11)20(18-17-13)12-9-5-2-6-10-12/h2,5-6,9-11,13-14H,1,3-4,7-8H2