pentyl 2-(4-methyl-6-oxidanylidene-2-phenyl-1,3-diazinan-5-yl)hexanoate

Systemtic Name: pentyl 2-(4-methyl-6-oxidanylidene-2-phenyl-1,3-diazinan-5-yl)hexanoate Openeye Name: pentyl 2-(4-methyl-6-oxo-2-phenyl-hexahydropyrimidin-5-yl)hexanoate CAS Name: 2-(4-methyl-6-oxo-2-phenyl-1,3-diazinan-5-yl)hexanoic acid pentyl ester IUPAC Name: pentyl 2-(4-methyl-6-oxo-2-phenyl-1,3-diazinan-5-yl)hexanoate Traditional Name: 2-(4-keto-6-methyl-2-phenyl-hexahydropyrimidin-5-yl)hexanoic acid amyl ester Formula: C22H34N2O3 MolecularWeight: 374.51696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCCC)C1C(NC(NC1=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCCCOC(=O)C(CCCC)C1C(NC(NC1=O)C2=CC=CC=C2)C

InChI

InChI=1S/C22H34N2O3/c1-4-6-11-15-27-22(26)18(14-7-5-2)19-16(3)23-20(24-21(19)25)17-12-9-8-10-13-17/h8-10,12-13,16,18-20,23H,4-7,11,14-15H2,1-3H3,(H,24,25)