3-methyl-N-octadecyl-2-[2-(4-phenyldiazenylphenoxy)ethanoylamino]pentanamide

Systemtic Name: 3-methyl-N-octadecyl-2-[2-(4-phenyldiazenylphenoxy)ethanoylamino]pentanamide Openeye Name: 3-methyl-N-octadecyl-2-[[2-(4-phenylazophenoxy)acetyl]amino]pentanamide CAS Name: 3-methyl-N-octadecyl-2-[[1-oxo-2-(4-phenyldiazenylphenoxy)ethyl]amino]pentanamide IUPAC Name: 3-methyl-N-octadecyl-2-[[2-(4-phenyldiazenylphenoxy)acetyl]amino]pentanamide Traditional Name: 3-methyl-2-[[2-(4-phenylazophenoxy)acetyl]amino]-N-stearyl-valeramide Formula: C38H60N4O3 MolecularWeight: 620.908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)CC)NC(=O)COC1=CC=C(C=C1)N=NC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)CC)NC(=O)COC1=CC=C(C=C1)N=NC2=CC=CC=C2

InChI

InChI=1S/C38H60N4O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-30-39-38(44)37(32(3)5-2)40-36(43)31-45-35-28-26-34(27-29-35)42-41-33-24-21-20-22-25-33/h20-22,24-29,32,37H,4-19,23,30-31H2,1-3H3,(H,39,44)(H,40,43)