[4-(dodecanoyloxymethyl)-3-oxidanylidene-1-phenyl-pyrazolidin-4-yl]methyl dodecanoate

Systemtic Name: [4-(dodecanoyloxymethyl)-3-oxidanylidene-1-phenyl-pyrazolidin-4-yl]methyl dodecanoate Openeye Name: [4-(dodecanoyloxymethyl)-3-oxo-1-phenyl-pyrazolidin-4-yl]methyl dodecanoate CAS Name: dodecanoic acid [3-oxo-4-(1-oxododecoxymethyl)-1-phenyl-4-pyrazolidinyl]methyl ester IUPAC Name: [4-(dodecanoyloxymethyl)-3-oxo-1-phenylpyrazolidin-4-yl]methyl dodecanoate Traditional Name: lauric acid [3-keto-4-(lauroyloxymethyl)-1-phenyl-pyrazolidin-4-yl]methyl ester Formula: C35H58N2O5 MolecularWeight: 586.84542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC1(CN(NC1=O)C2=CC=CC=C2)COC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC1(CN(NC1=O)C2=CC=CC=C2)COC(=O)CCCCCCCCCCC

InChI

InChI=1S/C35H58N2O5/c1-3-5-7-9-11-13-15-17-22-26-32(38)41-29-35(28-37(36-34(35)40)31-24-20-19-21-25-31)30-42-33(39)27-23-18-16-14-12-10-8-6-4-2/h19-21,24-25H,3-18,22-23,26-30H2,1-2H3,(H,36,40)