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

Systemtic Name: 4-[5-(1-adamantyl)-2-pyridin-4-yl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(4-pyridyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-pyridin-4-yl-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-pyridin-4-yl-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(4-pyridyl)-1H-indol-3-yl]butylamine Formula: C27H33N3 MolecularWeight: 399.57102

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CC=NC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CC=NC=C6

InChI

InChI=1S/C27H33N3/c28-8-2-1-3-23-24-14-22(27-15-18-11-19(16-27)13-20(12-18)17-27)4-5-25(24)30-26(23)21-6-9-29-10-7-21/h4-7,9-10,14,18-20,30H,1-3,8,11-13,15-17,28H2