ethyl (E)-3-[3-(4-fluorophenyl)-1-(1-oxidanylpropan-2-yl)indol-2-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-(4-fluorophenyl)-1-(1-oxidanylpropan-2-yl)indol-2-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-(4-fluorophenyl)-1-(2-hydroxy-1-methyl-ethyl)indol-2-yl]prop-2-enoate CAS Name: (E)-3-[3-(4-fluorophenyl)-1-(1-hydroxypropan-2-yl)-2-indolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-(4-fluorophenyl)-1-(1-hydroxypropan-2-yl)indol-2-yl]prop-2-enoate Traditional Name: (E)-3-[3-(4-fluorophenyl)-1-(2-hydroxy-1-methyl-ethyl)indol-2-yl]acrylic acid ethyl ester Formula: C22H22FNO3 MolecularWeight: 367.413383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C2=CC=CC=C2N1C(C)CO)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C2=CC=CC=C2N1C(C)CO)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FNO3/c1-3-27-21(26)13-12-20-22(16-8-10-17(23)11-9-16)18-6-4-5-7-19(18)24(20)15(2)14-25/h4-13,15,25H,3,14H2,1-2H3/b13-12+