7-(4-methylsulfonyl-2-nitro-phenoxy)-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 7-(4-methylsulfonyl-2-nitro-phenoxy)-4-(trifluoromethyl)chromen-2-one Openeye Name: 7-(4-methylsulfonyl-2-nitro-phenoxy)-4-(trifluoromethyl)chromen-2-one CAS Name: 7-(4-methylsulfonyl-2-nitrophenoxy)-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 7-(4-methylsulfonyl-2-nitrophenoxy)-4-(trifluoromethyl)chromen-2-one Traditional Name: 7-(4-mesyl-2-nitro-phenoxy)-4-(trifluoromethyl)coumarin Formula: C17H10F3NO7S MolecularWeight: 429.32401

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H10F3NO7S/c1-29(25,26)10-3-5-14(13(7-10)21(23)24)27-9-2-4-11-12(17(18,19)20)8-16(22)28-15(11)6-9/h2-8H,1H3