(5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)

C131H188N20O11 — CID 158348045

About (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)

(5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane) (PubChem CID 158348045) has the molecular formula C131H188N20O11 and a molecular weight of 2223.09 g/mol. Its IUPAC name is (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane).

Molecular Properties

• Compound Name: (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)
• PubChem CID: 158348045
• Molecular Formula: C131H188N20O11
• Molecular Weight: 2223.09 g/mol
• Exact Mass: 2221.49
• IUPAC Name: (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)
• SMILES: CO.Cn1cc2c(n1)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC2.Cn1cc2c(n1)[C@@]1(C)CCC3(OCCO3)C(C)(C)[C@@H]1CC2.Cn1ncc2c1[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC2.Cn1ncc2c1[C@@]1(C)CCC3(OCCO3)C(C)(C)[C@@H]1CC2.[3H]C.[3H]C.[C-]#[N+]C1=C(O)C(C)(C)[C@@H]2CCc3cn(C)nc3[C@@]2(C)C1.[C-]#[N+]C1=C(O)C(C)(C)[C@@H]2CCc3cnn(C)c3[C@@]2(C)C1.[C-]#[N+]C1=C[C@]2(C)c3c(cnn3C)CC[C@H]2C(C)(C)C1=O.[C-]#[N+]C1=C[C@]2(C)c3nn(C)cc3CC[C@H]2C(C)(C)C1=O
• InChI: InChI=1S/2C17H26N2O2.C16H21N3O.C16H19N3O.C16H21N3O.C16H19N3O.2C15H22N2O.CH4O.2CH4/c1-15(2)13-6-5-12-11-19(4)18-14(12)16(13,3)7-8-17(15)20-9-10-21-17;1-15(2)13-6-5-12-11-18-19(4)14(12)16(13,3)7-8-17(15)20-9-10-21-17;2*1-15(2)12-7-6-10-9-19(5)18-13(10)16(12,3)8-11(17-4)14(15)20;2*1-15(2)12-7-6-10-9-18-19(5)13(10)16(12,3)8-11(17-4)14(15)20;1-14(2)11-6-5-10-9-17(4)16-13(10)15(11,3)8-7-12(14)18;1-14(2)11-6-5-10-9-16-17(4)13(10)15(11,3)8-7-12(14)18;1-2;;/h2*11,13H,5-10H2,1-4H3;9,12,20H,6-8H2,1-3,5H3;8-9,12H,6-7H2,1-3,5H3;9,12,20H,6-8H2,1-3,5H3;8-9,12H,6-7H2,1-3,5H3;2*9,11H,5-8H2,1-4H3;2H,1H3;2*1H4/t2*13-,16-;4*12-,16-;2*11-,15-;;;/m00000000.../s1/i;;;;;;;;;2*1T
• InChIKey: GRZBAPLJUUSTTI-PKGKHUFGSA-N
• XLogP: 23.77
• TPSA: 325.89 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 27
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2223.09
LogP ≤ 5	23.77
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)?

The IUPAC name of (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane) (CID 158348045) is (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane).

What is the SMILES notation for (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)?

The canonical SMILES for (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane) is CO.Cn1cc2c(n1)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC2.Cn1cc2c(n1)[C@@]1(C)CCC3(OCCO3)C(C)(C)[C@@H]1CC2.Cn1ncc2c1[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC2.Cn1ncc2c1[C@@]1(C)CCC3(OCCO3)C(C)(C)[C@@H]1CC2.[3H]C.[3H]C.[C-]#[N+]C1=C(O)C(C)(C)[C@@H]2CCc3cn(C)nc3[C@@]2(C)C1.[C-]#[N+]C1=C(O)C(C)(C)[C@@H]2CCc3cnn(C)c3[C@@]2(C)C1.[C-]#[N+]C1=C[C@]2(C)c3c(cnn3C)CC[C@H]2C(C)(C)C1=O.[C-]#[N+]C1=C[C@]2(C)c3nn(C)cc3CC[C@H]2C(C)(C)C1=O.

What is the InChIKey of (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)?

The InChIKey is GRZBAPLJUUSTTI-PKGKHUFGSA-N. The full InChI is InChI=1S/2C17H26N2O2.C16H21N3O.C16H19N3O.C16H21N3O.C16H19N3O.2C15H22N2O.CH4O.2CH4/c1-15(2)13-6-5-12-11-19(4)18-14(12)16(13,3)7-8-17(15)20-9-10-21-17;1-15(2)13-6-5-12-11-18-19(4)14(12)16(13,3)7-8-17(15)20-9-10-21-17;2*1-15(2)12-7-6-10-9-19(5)18-13(10)16(12,3)8-11(17-4)14(15)20;2*1-15(2)12-7-6-10-9-18-19(5)13(10)16(12,3)8-11(17-4)14(15)20;1-14(2)11-6-5-10-9-17(4)16-13(10)15(11,3)8-7-12(14)18;1-14(2)11-6-5-10-9-16-17(4)13(10)15(11,3)8-7-12(14)18;1-2;;/h2*11,13H,5-10H2,1-4H3;9,12,20H,6-8H2,1-3,5H3;8-9,12H,6-7H2,1-3,5H3;9,12,20H,6-8H2,1-3,5H3;8-9,12H,6-7H2,1-3,5H3;2*9,11H,5-8H2,1-4H3;2H,1H3;2*1H4/t2*13-,16-;4*12-,16-;2*11-,15-;;;/m00000000.../s1/i;;;;;;;;;2*1T.

What are the key properties of (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane)?

(5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane) has a molecular weight of 2223.09 g/mol, XLogP of 23.77, 0 rotatable bonds, 3 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for (5aR,9aS)-1,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-2,6,6,9a-tetramethyl-5,5a,8,9-tetrahydro-4H-benzo[g]indazol-7-one;(5'aR,9'aS)-1',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5'aR,9'aS)-2',6',6',9'a-tetramethylspiro[1,3-dioxolane-2,7'-5,5a,8,9-tetrahydro-4H-benzo[g]indazole];(5aR,9aR)-8-isocyano-1,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aR)-8-isocyano-2,6,6,9a-tetramethyl-5,5a-dihydro-4H-benzo[g]indazol-7-one;(5aR,9aS)-8-isocyano-1,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;(5aR,9aS)-8-isocyano-2,6,6,9a-tetramethyl-4,5,5a,9-tetrahydrobenzo[g]indazol-7-ol;methanol;bis(tritiomethane) is sourced from PubChem (CID 158348045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).