(E)-N-[2-(1-octadecylbenzimidazol-2-yl)ethyl]but-2-enamide

Systemtic Name: (E)-N-[2-(1-octadecylbenzimidazol-2-yl)ethyl]but-2-enamide Openeye Name: (E)-N-[2-(1-octadecylbenzimidazol-2-yl)ethyl]but-2-enamide CAS Name: (E)-N-[2-(1-octadecyl-2-benzimidazolyl)ethyl]-2-butenamide IUPAC Name: (E)-N-[2-(1-octadecylbenzimidazol-2-yl)ethyl]but-2-enamide Traditional Name: (E)-N-[2-(1-stearylbenzimidazol-2-yl)ethyl]but-2-enamide Formula: C31H51N3O MolecularWeight: 481.75614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1CCNC(=O)C=CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1CCNC(=O)/C=C/C

InChI

InChI=1S/C31H51N3O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-27-34-29-24-20-19-23-28(29)33-30(34)25-26-32-31(35)22-4-2/h4,19-20,22-24H,3,5-18,21,25-27H2,1-2H3,(H,32,35)/b22-4+