3-[5-[[2,6-bis(chloranyl)phenyl]methoxy]-3-methanoyl-indol-1-yl]butanenitrile

Systemtic Name: 3-[5-[[2,6-bis(chloranyl)phenyl]methoxy]-3-methanoyl-indol-1-yl]butanenitrile Openeye Name: 3-[5-[(2,6-dichlorophenyl)methoxy]-3-formyl-indol-1-yl]butanenitrile CAS Name: 3-[5-[(2,6-dichlorophenyl)methoxy]-3-formyl-1-indolyl]butanenitrile IUPAC Name: 3-[5-[(2,6-dichlorophenyl)methoxy]-3-formylindol-1-yl]butanenitrile Traditional Name: 3-[5-(2,6-dichlorobenzyl)oxy-3-formyl-indol-1-yl]butyronitrile Formula: C20H16Cl2N2O2 MolecularWeight: 387.25924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)N1C=C(C2=C1C=CC(=C2)OCC3=C(C=CC=C3Cl)Cl)C=O

Isomeric SMILES

CC(CC#N)N1C=C(C2=C1C=CC(=C2)OCC3=C(C=CC=C3Cl)Cl)C=O

InChI

InChI=1S/C20H16Cl2N2O2/c1-13(7-8-23)24-10-14(11-25)16-9-15(5-6-20(16)24)26-12-17-18(21)3-2-4-19(17)22/h2-6,9-11,13H,7,12H2,1H3