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

Systemtic Name: 4-[5-(1-adamantyl)-2-phenyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-phenyl-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-phenyl-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-phenyl-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-phenyl-1H-indol-3-yl]butylamine Formula: C28H34N2 MolecularWeight: 398.58296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N2/c29-11-5-4-8-24-25-15-23(28-16-19-12-20(17-28)14-21(13-19)18-28)9-10-26(25)30-27(24)22-6-2-1-3-7-22/h1-3,6-7,9-10,15,19-21,30H,4-5,8,11-14,16-18,29H2