5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)ethenyl]indol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: 5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)ethenyl]indol-1-yl]methyl]furan-2-carboxylate Openeye Name: 5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)vinyl]indol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)ethenyl]-1-indolyl]methyl]-2-furancarboxylate IUPAC Name: 5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)ethenyl]indol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3-[(Z)-2-cyano-2-(4-fluorophenyl)vinyl]indol-1-yl]methyl]-2-furoate Formula: C23H14FN2O3- MolecularWeight: 385.367263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(O3)C(=O)[O-])C=C(C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(O3)C(=O)[O-])/C=C(\C#N)/C4=CC=C(C=C4)F

InChI

InChI=1S/C23H15FN2O3/c24-18-7-5-15(6-8-18)16(12-25)11-17-13-26(21-4-2-1-3-20(17)21)14-19-9-10-22(29-19)23(27)28/h1-11,13H,14H2,(H,27,28)/p-1/b16-11+