2-[1-bromanyl-6-[3-pentyl-1-(phenylmethyl)indol-2-yl]naphthalen-2-yl]oxyethanenitrile

Systemtic Name: 2-[1-bromanyl-6-[3-pentyl-1-(phenylmethyl)indol-2-yl]naphthalen-2-yl]oxyethanenitrile Openeye Name: 2-[[6-(1-benzyl-3-pentyl-indol-2-yl)-1-bromo-2-naphthyl]oxy]acetonitrile CAS Name: 2-[[1-bromo-6-[3-pentyl-1-(phenylmethyl)-2-indolyl]-2-naphthalenyl]oxy]acetonitrile IUPAC Name: 2-[6-(1-benzyl-3-pentylindol-2-yl)-1-bromonaphthalen-2-yl]oxyacetonitrile Traditional Name: 2-[6-(3-amyl-1-benzyl-indol-2-yl)-1-bromo-2-naphthoxy]acetonitrile Formula: C32H29BrN2O MolecularWeight: 537.48946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC5=C(C=C4)C(=C(C=C5)OCC#N)Br

Isomeric SMILES

CCCCCC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC5=C(C=C4)C(=C(C=C5)OCC#N)Br

InChI

InChI=1S/C32H29BrN2O/c1-2-3-5-13-28-27-12-8-9-14-29(27)35(22-23-10-6-4-7-11-23)32(28)25-15-17-26-24(21-25)16-18-30(31(26)33)36-20-19-34/h4,6-12,14-18,21H,2-3,5,13,20,22H2,1H3