[[4-(1-oxidanylhexyl)phenyl]methyl-propanoyl-amino] octanoate

Systemtic Name: [[4-(1-oxidanylhexyl)phenyl]methyl-propanoyl-amino] octanoate Openeye Name: [[4-(1-hydroxyhexyl)phenyl]methyl-propanoyl-amino] octanoate CAS Name: octanoic acid [[4-(1-hydroxyhexyl)phenyl]methyl-(1-oxopropyl)amino] ester IUPAC Name: [[4-(1-hydroxyhexyl)phenyl]methyl-propanoylamino] octanoate Traditional Name: caprylic acid [[4-(1-hydroxyhexyl)benzyl]-propionyl-amino] ester Formula: C24H39NO4 MolecularWeight: 405.57076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)ON(CC1=CC=C(C=C1)C(CCCCC)O)C(=O)CC

Isomeric SMILES

CCCCCCCC(=O)ON(CC1=CC=C(C=C1)C(CCCCC)O)C(=O)CC

InChI

InChI=1S/C24H39NO4/c1-4-7-9-10-12-14-24(28)29-25(23(27)6-3)19-20-15-17-21(18-16-20)22(26)13-11-8-5-2/h15-18,22,26H,4-14,19H2,1-3H3