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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

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