sodium 1-[4-[chloranyl-bis(fluoranyl)methyl]-6-methoxy-1,3,5-triazin-2-yl]-3-(2-nitrophenyl)sulfonyl-urea

Systemtic Name: sodium 1-[4-[chloranyl-bis(fluoranyl)methyl]-6-methoxy-1,3,5-triazin-2-yl]-3-(2-nitrophenyl)sulfonyl-urea Openeye Name: sodium 1-[4-[chloro(difluoro)methyl]-6-methoxy-1,3,5-triazin-2-yl]-3-(2-nitrophenyl)sulfonyl-urea CAS Name: sodium 1-[4-[chloro(difluoro)methyl]-6-methoxy-1,3,5-triazin-2-yl]-3-(2-nitrophenyl)sulfonylurea IUPAC Name: sodium 1-[4-[chloro(difluoro)methyl]-6-methoxy-1,3,5-triazin-2-yl]-3-(2-nitrophenyl)sulfonylurea Traditional Name: sodium 1-[4-[chloro(difluoro)methyl]-6-methoxy-s-triazin-2-yl]-3-(2-nitrophenyl)sulfonyl-urea Formula: C12H9ClF2N6NaO6S+ MolecularWeight: 461.741036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(F)(F)Cl.[Na+]

Isomeric SMILES

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(F)(F)Cl.[Na+]

InChI

InChI=1S/C12H9ClF2N6O6S.Na/c1-27-11-17-8(12(13,14)15)16-9(19-11)18-10(22)20-28(25,26)7-5-3-2-4-6(7)21(23)24;/h2-5H,1H3,(H2,16,17,18,19,20,22);/q;+1