N-[2-(1-hexadecylbenzimidazol-2-yl)ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-(1-hexadecylbenzimidazol-2-yl)ethyl]adamantane-1-carboxamide Openeye Name: N-[2-(1-hexadecylbenzimidazol-2-yl)ethyl]adamantane-1-carboxamide CAS Name: N-[2-(1-hexadecyl-2-benzimidazolyl)ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(1-hexadecylbenzimidazol-2-yl)ethyl]adamantane-1-carboxamide Traditional Name: N-[2-(1-cetylbenzimidazol-2-yl)ethyl]adamantane-1-carboxamide Formula: C36H57N3O MolecularWeight: 547.85728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C36H57N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-22-39-33-19-16-15-18-32(33)38-34(39)20-21-37-35(40)36-26-29-23-30(27-36)25-31(24-29)28-36/h15-16,18-19,29-31H,2-14,17,20-28H2,1H3,(H,37,40)