(E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-[(7-ethyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-[(7-ethyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-(7-ethyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-[(7-ethyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(7-ethyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-(7-ethyl-1H-indole-3-carbonyl)acrylonitrile Formula: C21H17BrN2O3 MolecularWeight: 425.27528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)C#N

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)/C(=C/C3=CC(=C(C(=C3)Br)O)OC)/C#N

InChI

InChI=1S/C21H17BrN2O3/c1-3-13-5-4-6-15-16(11-24-19(13)15)20(25)14(10-23)7-12-8-17(22)21(26)18(9-12)27-2/h4-9,11,24,26H,3H2,1-2H3/b14-7+