6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)indol-1-yl]methyl]pyridin-2-amine

Systemtic Name: 6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)indol-1-yl]methyl]pyridin-2-amine Openeye Name: 6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)indol-1-yl]methyl]pyridin-2-amine CAS Name: 6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)-1-indolyl]methyl]-2-pyridinamine IUPAC Name: 6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)indol-1-yl]methyl]pyridin-2-amine Traditional Name: [6-[[2-(2-chlorophenyl)-6-(4-methoxybut-1-ynyl)indol-1-yl]methyl]-2-pyridyl]amine Formula: C25H22ClN3O MolecularWeight: 415.91468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3O/c1-30-14-5-4-7-18-12-13-19-16-24(21-9-2-3-10-22(21)26)29(23(19)15-18)17-20-8-6-11-25(27)28-20/h2-3,6,8-13,15-16H,5,14,17H2,1H3,(H2,27,28)