(Z)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Systemtic Name: (Z)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Openeye Name: (Z)-3-(3-bromo-4-hydroxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide CAS Name: (Z)-3-(3-bromo-4-hydroxyphenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide IUPAC Name: (Z)-3-(3-bromo-4-hydroxyphenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Traditional Name: (Z)-3-(3-bromo-4-hydroxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]acrylamide Formula: C20H16BrN3O2 MolecularWeight: 410.26394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C(=CC3=CC(=C(C=C3)O)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)/C(=C\C3=CC(=C(C=C3)O)Br)/C#N

InChI

InChI=1S/C20H16BrN3O2/c21-17-10-13(5-6-19(17)25)9-15(11-22)20(26)23-8-7-14-12-24-18-4-2-1-3-16(14)18/h1-6,9-10,12,24-25H,7-8H2,(H,23,26)/b15-9-