7-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 7-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-4-(trifluoromethyl)chromen-2-one Openeye Name: 7-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethoxy]-4-(trifluoromethyl)chromen-2-one CAS Name: 7-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethoxy]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 7-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethoxy]-4-(trifluoromethyl)chromen-2-one Traditional Name: 7-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethoxy]-4-(trifluoromethyl)coumarin Formula: C21H20F3NO4 MolecularWeight: 407.38301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C

InChI

InChI=1S/C21H20F3NO4/c1-4-7-25-12(2)8-16(13(25)3)18(26)11-28-14-5-6-15-17(21(22,23)24)10-20(27)29-19(15)9-14/h5-6,8-10H,4,7,11H2,1-3H3