3-[3-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(2-bromo-4-methyl-phenoxy)acetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(2-bromo-4-methylphenoxy)acetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-(2-bromo-4-methyl-phenoxy)acetyl]indol-1-yl]propionitrile Formula: C20H17BrN2O2 MolecularWeight: 397.26518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N)Br

InChI

InChI=1S/C20H17BrN2O2/c1-14-7-8-20(17(21)11-14)25-13-19(24)16-12-23(10-4-9-22)18-6-3-2-5-15(16)18/h2-3,5-8,11-12H,4,10,13H2,1H3