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

Systemtic Name: N-octadecyl-N'-[3,4,5-tris(oxidanyl)phenyl]propanediamide Openeye Name: N-octadecyl-N'-(3,4,5-trihydroxyphenyl)propanediamide CAS Name: N-octadecyl-N'-(3,4,5-trihydroxyphenyl)propanediamide IUPAC Name: N-octadecyl-N'-(3,4,5-trihydroxyphenyl)propanediamide Traditional Name: N-stearyl-N'-(3,4,5-trihydroxyphenyl)malonamide Formula: C27H46N2O5 MolecularWeight: 478.66454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)CC(=O)NC1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)CC(=O)NC1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C27H46N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-25(32)21-26(33)29-22-19-23(30)27(34)24(31)20-22/h19-20,30-31,34H,2-18,21H2,1H3,(H,28,32)(H,29,33)