5-(2,6-dimethylheptan-2-yl)-3-(2-methylbutan-2-yl)-2-oxidanyl-benzohydrazide phosphate

Systemtic Name: 5-(2,6-dimethylheptan-2-yl)-3-(2-methylbutan-2-yl)-2-oxidanyl-benzohydrazide phosphate Openeye Name: 3-(1,1-dimethylpropyl)-2-hydroxy-5-(1,1,5-trimethylhexyl)benzohydrazide phosphate CAS Name: 5-(2,6-dimethylheptan-2-yl)-2-hydroxy-3-(2-methylbutan-2-yl)benzohydrazide phosphate IUPAC Name: 5-(2,6-dimethylheptan-2-yl)-2-hydroxy-3-(2-methylbutan-2-yl)benzohydrazide phosphate Traditional Name: 3-tert-amyl-2-hydroxy-5-(1,1,5-trimethylhexyl)benzohydrazide phosphate Formula: C21H36N2O6P-3 MolecularWeight: 443.494101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C(=CC(=C1)C(C)(C)CCCC(C)C)C(=O)NN)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCC(C)(C)C1=C(C(=CC(=C1)C(C)(C)CCCC(C)C)C(=O)NN)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C21H36N2O2.H3O4P/c1-8-20(4,5)17-13-15(12-16(18(17)24)19(25)23-22)21(6,7)11-9-10-14(2)3;1-5(2,3)4/h12-14,24H,8-11,22H2,1-7H3,(H,23,25);(H3,1,2,3,4)/p-3