3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromone Formula: C22H20F3NO5 MolecularWeight: 435.39311

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)CN(C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)CN(C)C)O

InChI

InChI=1S/C22H20F3NO5/c1-4-11-7-13-19(28)17(12-5-6-15-16(8-12)30-10-29-15)21(22(23,24)25)31-20(13)14(18(11)27)9-26(2)3/h5-8,27H,4,9-10H2,1-3H3