[2-(hexanoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl hexanoate

Systemtic Name: [2-(hexanoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl hexanoate Openeye Name: [2-(hexanoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl hexanoate CAS Name: hexanoic acid [2-(1-oxohexoxymethyl)-1,3-dihydroperimidin-2-yl]methyl ester IUPAC Name: [2-(hexanoyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl hexanoate Traditional Name: hexanoic acid [2-(caproyloxymethyl)-1,3-dihydroperimidin-2-yl]methyl ester Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC1(NC2=CC=CC3=C2C(=CC=C3)N1)COC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OCC1(NC2=CC=CC3=C2C(=CC=C3)N1)COC(=O)CCCCC

InChI

InChI=1S/C25H34N2O4/c1-3-5-7-15-22(28)30-17-25(18-31-23(29)16-8-6-4-2)26-20-13-9-11-19-12-10-14-21(27-25)24(19)20/h9-14,26-27H,3-8,15-18H2,1-2H3