N-(4-octadecoxyphenyl)-N'-[3,4,5-tris(oxidanyl)phenyl]propanediamide

Systemtic Name: N-(4-octadecoxyphenyl)-N'-[3,4,5-tris(oxidanyl)phenyl]propanediamide Openeye Name: N-(4-octadecoxyphenyl)-N'-(3,4,5-trihydroxyphenyl)propanediamide CAS Name: N-(4-octadecoxyphenyl)-N'-(3,4,5-trihydroxyphenyl)propanediamide IUPAC Name: N-(4-octadecoxyphenyl)-N'-(3,4,5-trihydroxyphenyl)propanediamide Traditional Name: N-(4-stearyloxyphenyl)-N'-(3,4,5-trihydroxyphenyl)malonamide Formula: C33H50N2O6 MolecularWeight: 570.7599

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)NC(=O)CC(=O)NC2=CC(=C(C(=C2)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)NC(=O)CC(=O)NC2=CC(=C(C(=C2)O)O)O

InChI

InChI=1S/C33H50N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-41-28-20-18-26(19-21-28)34-31(38)25-32(39)35-27-23-29(36)33(40)30(37)24-27/h18-21,23-24,36-37,40H,2-17,22,25H2,1H3,(H,34,38)(H,35,39)