(E)-3-(4-ethoxy-3-methoxy-phenyl)-2-[(6-fluoranyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-2-[(6-fluoranyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-2-(6-fluoro-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-2-[(6-fluoro-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-2-(6-fluoro-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-2-(6-fluoro-1H-indole-3-carbonyl)acrylonitrile Formula: C21H17FN2O3 MolecularWeight: 364.369683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)C2=CNC3=C2C=CC(=C3)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CNC3=C2C=CC(=C3)F)OC

InChI

InChI=1S/C21H17FN2O3/c1-3-27-19-7-4-13(9-20(19)26-2)8-14(11-23)21(25)17-12-24-18-10-15(22)5-6-16(17)18/h4-10,12,24H,3H2,1-2H3/b14-8+