3-(5-bromanyl-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide

Systemtic Name: 3-(5-bromanyl-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide Openeye Name: 3-(5-bromo-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide CAS Name: 3-(5-bromo-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)-2-propenamide IUPAC Name: 3-(5-bromo-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide Traditional Name: 3-(5-bromo-1H-indol-3-yl)-2-cyano-N-(3,4-dimethoxyphenyl)acrylamide Formula: C20H16BrN3O3 MolecularWeight: 426.26334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CNC3=C2C=C(C=C3)Br)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CNC3=C2C=C(C=C3)Br)C#N)OC

InChI

InChI=1S/C20H16BrN3O3/c1-26-18-6-4-15(9-19(18)27-2)24-20(25)12(10-22)7-13-11-23-17-5-3-14(21)8-16(13)17/h3-9,11,23H,1-2H3,(H,24,25)