8-(dimethylaminomethyl)-2-ethyl-3-(4-fluoranylphenoxy)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 8-(dimethylaminomethyl)-2-ethyl-3-(4-fluoranylphenoxy)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 8-(dimethylaminomethyl)-2-ethyl-3-(4-fluorophenoxy)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 8-(dimethylaminomethyl)-2-ethyl-3-(4-fluorophenoxy)-4-hydroxy-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 8-(dimethylaminomethyl)-2-ethyl-3-(4-fluorophenoxy)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 8-(dimethylaminomethyl)-2-ethyl-3-(4-fluorophenoxy)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Formula: C20H24FNO4 MolecularWeight: 361.407263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2CCC(=O)C(C2O1)CN(C)C)O)OC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=C(C(=C2CCC(=O)C(C2O1)CN(C)C)O)OC3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FNO4/c1-4-17-20(25-13-7-5-12(21)6-8-13)18(24)14-9-10-16(23)15(11-22(2)3)19(14)26-17/h5-8,15,19,24H,4,9-11H2,1-3H3