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

Systemtic Name: 4-[5-(1-adamantyl)-2-(2-bromophenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(2-bromophenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(2-bromophenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(2-bromophenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(2-bromophenyl)-1H-indol-3-yl]butylamine Formula: C28H33BrN2 MolecularWeight: 477.47902

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CC=CC=C6Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CC=CC=C6Br

InChI

InChI=1S/C28H33BrN2/c29-25-7-2-1-6-23(25)27-22(5-3-4-10-30)24-14-21(8-9-26(24)31-27)28-15-18-11-19(16-28)13-20(12-18)17-28/h1-2,6-9,14,18-20,31H,3-5,10-13,15-17,30H2