IUPAC Name :[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate
InChI :InChI=1/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3
Std.InChI: InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3
InChIKey :MGOHCFMYLBAPRN-UHFFFAOYAE
Std.InChIKey: MGOHCFMYLBAPRN-UHFFFAOYSA-N
SMILES :CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C
MDL: MFCD08690563
Molar Refractivity :112.30 ± 0.4 cm3 (est)
Parachor :900.5 ± 6.0 cm3 (est)
Index of Refraction :1.572 ± 0.03
(est)
Surface Tension :48.5 ± 5.0 dyne/cm (est)
Density :1.17 ± 0.1 g/cm3 (est)
Polarizability :44.52 ± 0.5 10-24cm3 (est)