4-(diethoxyphosphorylmethyl)-6-(hexan-2-ylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione

Systemtic Name: 4-(diethoxyphosphorylmethyl)-6-(hexan-2-ylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione Openeye Name: 4-(diethoxyphosphorylmethyl)-6-(1-methylpentylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione CAS Name: 4-(diethoxyphosphorylmethyl)-6-(hexan-2-ylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione IUPAC Name: 4-(diethoxyphosphorylmethyl)-6-(hexan-2-ylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione Traditional Name: 4-(diethoxyphosphorylmethyl)-6-(1-methylpentylamino)-7-(trifluoromethyl)-1H-quinoxaline-2,3-quinone Formula: C20H29F3N3O5P MolecularWeight: 479.430331

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=CC2=C(C=C1C(F)(F)F)NC(=O)C(=O)N2CP(=O)(OCC)OCC

Isomeric SMILES

CCCCC(C)NC1=CC2=C(C=C1C(F)(F)F)NC(=O)C(=O)N2CP(=O)(OCC)OCC

InChI

InChI=1S/C20H29F3N3O5P/c1-5-8-9-13(4)24-15-11-17-16(10-14(15)20(21,22)23)25-18(27)19(28)26(17)12-32(29,30-6-2)31-7-3/h10-11,13,24H,5-9,12H2,1-4H3,(H,25,27)