4-[3-(dimethylamino)propyl]-1-octadecyl-benzimidazole-2-carboxamide

Systemtic Name: 4-[3-(dimethylamino)propyl]-1-octadecyl-benzimidazole-2-carboxamide Openeye Name: 4-[3-(dimethylamino)propyl]-1-octadecyl-benzimidazole-2-carboxamide CAS Name: 4-[3-(dimethylamino)propyl]-1-octadecyl-2-benzimidazolecarboxamide IUPAC Name: 4-[3-(dimethylamino)propyl]-1-octadecylbenzimidazole-2-carboxamide Traditional Name: 4-[3-(dimethylamino)propyl]-1-stearyl-benzimidazole-2-carboxamide Formula: C31H54N4O MolecularWeight: 498.78666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C2=CC=CC(=C2N=C1C(=O)N)CCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C2=CC=CC(=C2N=C1C(=O)N)CCCN(C)C

InChI

InChI=1S/C31H54N4O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-35-28-24-20-22-27(23-21-25-34(2)3)29(28)33-31(35)30(32)36/h20,22,24H,4-19,21,23,25-26H2,1-3H3,(H2,32,36)