tert-butyl (E)-3-[6-fluoranyl-1-(phenylmethyl)indol-2-yl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[6-fluoranyl-1-(phenylmethyl)indol-2-yl]prop-2-enoate Openeye Name: tert-butyl (E)-3-(1-benzyl-6-fluoro-indol-2-yl)prop-2-enoate CAS Name: (E)-3-[6-fluoro-1-(phenylmethyl)-2-indolyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-(1-benzyl-6-fluoroindol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzyl-6-fluoro-indol-2-yl)acrylic acid tert-butyl ester Formula: C22H22FNO2 MolecularWeight: 351.413983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC2=C(N1CC3=CC=CC=C3)C=C(C=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC2=C(N1CC3=CC=CC=C3)C=C(C=C2)F

InChI

InChI=1S/C22H22FNO2/c1-22(2,3)26-21(25)12-11-19-13-17-9-10-18(23)14-20(17)24(19)15-16-7-5-4-6-8-16/h4-14H,15H2,1-3H3/b12-11+