1-(1,3-benzodioxol-5-yl)-4-(1-octadecylbenzimidazol-2-yl)pyrrolidin-2-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-4-(1-octadecylbenzimidazol-2-yl)pyrrolidin-2-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-4-(1-octadecylbenzimidazol-2-yl)pyrrolidin-2-one CAS Name: 1-(1,3-benzodioxol-5-yl)-4-(1-octadecyl-2-benzimidazolyl)-2-pyrrolidinone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-4-(1-octadecylbenzimidazol-2-yl)pyrrolidin-2-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-(1-stearylbenzimidazol-2-yl)-2-pyrrolidone Formula: C36H51N3O3 MolecularWeight: 573.80844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C36H51N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-38-32-21-18-17-20-31(32)37-36(38)29-25-35(40)39(27-29)30-22-23-33-34(26-30)42-28-41-33/h17-18,20-23,26,29H,2-16,19,24-25,27-28H2,1H3