6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)indol-1-yl]methyl]pyridin-2-amine

Systemtic Name: 6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)indol-1-yl]methyl]pyridin-2-amine Openeye Name: 6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)indol-1-yl]methyl]pyridin-2-amine CAS Name: 6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)-1-indolyl]methyl]-2-pyridinamine IUPAC Name: 6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)indol-1-yl]methyl]pyridin-2-amine Traditional Name: [6-[[2-(2-chlorophenyl)-6-(6-methoxyhex-1-ynyl)indol-1-yl]methyl]-2-pyridyl]amine Formula: C27H26ClN3O MolecularWeight: 443.96784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCCC#CC1=CC2=C(C=C1)C=C(N2CC3=NC(=CC=C3)N)C4=CC=CC=C4Cl

Isomeric SMILES

COCCCCC#CC1=CC2=C(C=C1)C=C(N2CC3=NC(=CC=C3)N)C4=CC=CC=C4Cl

InChI

InChI=1S/C27H26ClN3O/c1-32-16-7-3-2-4-9-20-14-15-21-18-26(23-11-5-6-12-24(23)28)31(25(21)17-20)19-22-10-8-13-27(29)30-22/h5-6,8,10-15,17-18H,2-3,7,16,19H2,1H3,(H2,29,30)