7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one

Systemtic Name: 7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one Openeye Name: 7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propyl-chromen-2-one CAS Name: 7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propylchromen-2-one Traditional Name: 7-[2-nitro-4-(trifluoromethyl)phenoxy]-4-propyl-coumarin Formula: C19H14F3NO5 MolecularWeight: 393.31337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14F3NO5/c1-2-3-11-8-18(24)28-17-10-13(5-6-14(11)17)27-16-7-4-12(19(20,21)22)9-15(16)23(25)26/h4-10H,2-3H2,1H3