(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-(1H-indol-3-ylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-(1H-indol-3-ylcarbonyl)prop-2-enenitrile Openeye Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-(1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-[1H-indol-3-yl(oxo)methyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-(1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-(1H-indole-3-carbonyl)acrylonitrile Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CNC3=CC=CC=C32)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)C2=CNC3=CC=CC=C32)Br)OCC=C

InChI

InChI=1S/C22H17BrN2O3/c1-3-8-28-22-18(23)10-14(11-20(22)27-2)9-15(12-24)21(26)17-13-25-19-7-5-4-6-16(17)19/h3-7,9-11,13,25H,1,8H2,2H3/b15-9+