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

Systemtic Name: ethyl (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-oxidanyl-prop-2-enoate Openeye Name: ethyl (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-hydroxy-prop-2-enoate CAS Name: (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]-3-indolyl]-2-hydroxy-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-hydroxyprop-2-enoate Traditional Name: (E)-3-cyano-3-[1-(4-fluorobenzyl)indol-3-yl]-2-hydroxy-acrylic acid ethyl ester Formula: C21H17FN2O3 MolecularWeight: 364.369683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C#N)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)F)O

Isomeric SMILES

CCOC(=O)/C(=C(\C#N)/C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)F)/O

InChI

InChI=1S/C21H17FN2O3/c1-2-27-21(26)20(25)17(11-23)18-13-24(19-6-4-3-5-16(18)19)12-14-7-9-15(22)10-8-14/h3-10,13,25H,2,12H2,1H3/b20-17-