7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one

Systemtic Name: 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one Openeye Name: 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one CAS Name: 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propylchromen-2-one Traditional Name: 7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-propyl-coumarin Formula: C19H13F3N2O7 MolecularWeight: 438.31093

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H13F3N2O7/c1-2-3-10-6-17(25)31-16-9-12(4-5-13(10)16)30-18-14(23(26)27)7-11(19(20,21)22)8-15(18)24(28)29/h4-9H,2-3H2,1H3