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

Systemtic Name: N'-[3,4-bis(oxidanyl)phenyl]-N-octadecyl-propanediamide Openeye Name: N'-(3,4-dihydroxyphenyl)-N-octadecyl-propanediamide CAS Name: N'-(3,4-dihydroxyphenyl)-N-octadecylpropanediamide IUPAC Name: N'-(3,4-dihydroxyphenyl)-N-octadecylpropanediamide Traditional Name: N'-(3,4-dihydroxyphenyl)-N-stearyl-malonamide Formula: C27H46N2O4 MolecularWeight: 462.66514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H46N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-26(32)22-27(33)29-23-18-19-24(30)25(31)21-23/h18-19,21,30-31H,2-17,20,22H2,1H3,(H,28,32)(H,29,33)