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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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