3-[3-[2-(2-chloranyl-4-phenyl-phenoxy)ethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-(2-chloranyl-4-phenyl-phenoxy)ethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(2-chloro-4-phenyl-phenoxy)acetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-(2-chloro-4-phenylphenoxy)-1-oxoethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(2-chloro-4-phenylphenoxy)acetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-(2-chloro-4-phenyl-phenoxy)acetyl]indol-1-yl]propionitrile Formula: C25H19ClN2O2 MolecularWeight: 414.88356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(=O)C3=CN(C4=CC=CC=C43)CCC#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(=O)C3=CN(C4=CC=CC=C43)CCC#N)Cl

InChI

InChI=1S/C25H19ClN2O2/c26-22-15-19(18-7-2-1-3-8-18)11-12-25(22)30-17-24(29)21-16-28(14-6-13-27)23-10-5-4-9-20(21)23/h1-5,7-12,15-16H,6,14,17H2