3-pentyl-5-phenyl-adamantan-1-amine

Systemtic Name: 3-pentyl-5-phenyl-adamantan-1-amine Openeye Name: 3-pentyl-5-phenyl-adamantan-1-amine CAS Name: 3-pentyl-5-phenyl-1-adamantanamine IUPAC Name: 3-pentyl-5-phenyladamantan-1-amine Traditional Name: (3-amyl-5-phenyl-1-adamantyl)amine Formula: C21H31N MolecularWeight: 297.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CC3CC(C1)(CC(C3)(C2)N)C4=CC=CC=C4

Isomeric SMILES

CCCCCC12CC3CC(C1)(CC(C3)(C2)N)C4=CC=CC=C4

InChI

InChI=1S/C21H31N/c1-2-3-7-10-19-11-17-12-20(14-19,16-21(22,13-17)15-19)18-8-5-4-6-9-18/h4-6,8-9,17H,2-3,7,10-16,22H2,1H3