4-[5-(1-adamantyl)-2-(6-methoxypyridin-2-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-(1-adamantyl)-2-(6-methoxypyridin-2-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(6-methoxy-2-pyridyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(6-methoxy-2-pyridinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(6-methoxypyridin-2-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(6-methoxy-2-pyridyl)-1H-indol-3-yl]butylamine Formula: C28H35N3O MolecularWeight: 429.597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=N1)C2=C(C3=C(N2)C=CC(=C3)C45CC6CC(C4)CC(C6)C5)CCCCN

Isomeric SMILES

COC1=CC=CC(=N1)C2=C(C3=C(N2)C=CC(=C3)C45CC6CC(C4)CC(C6)C5)CCCCN

InChI

InChI=1S/C28H35N3O/c1-32-26-7-4-6-25(30-26)27-22(5-2-3-10-29)23-14-21(8-9-24(23)31-27)28-15-18-11-19(16-28)13-20(12-18)17-28/h4,6-9,14,18-20,31H,2-3,5,10-13,15-17,29H2,1H3