(2S,5R)-N-[4-(2-amino-2-oxoethyl)phenyl]-5-methyl-2-(propan-2-yl)cyclohexanecarboxamide

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IUPAC Name :(2S,5R)-N-[4-(2-amino-2-oxo-ethyl)phenyl]-2-isopropyl-5-methyl-cyclohexanecarboxamide
InChI :InChI=1/C19H28N2O2/c1-12(2)16-9-4-13(3)10-17(16)19(23)21-15-7-5-14(6-8-15)11-18(20)22/h5-8,12-13,16-17H,4,9-11H2,1-3H3,(H2,20,22)(H,21,23)/t13-,16+,17?/m1/s1
Std.InChI: InChI=1S/C19H28N2O2/c1-12(2)16-9-4-13(3)10-17(16)19(23)21-15-7-5-14(6-8-15)11-18(20)22/h5-8,12-13,16-17H,4,9-11H2,1-3H3,(H2,20,22)(H,21,23)/t13-,16+,17?/m1/s1
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InChIKey :RLYVZCMMEXADQB-WBTZKQGOBO
Std.InChIKey: RLYVZCMMEXADQB-WBTZKQGOSA-N
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SMILES :C[C@@H]1CC[C@H](C(C1)C(=O)Nc2ccc(cc2)CC(=O)N)C(C)C
Molar Refractivity :91.12 ± 0.5 cm3 (est)
Parachor :694.0 ± 8.0 cm3 (est)
Index of Refraction :1.577 ± 0.05 (est)
Surface Tension :40.6 ± 7.0 dyne/cm (est)
Density :1.15 ± 0.1 g/cm3 (est)
Polarizability :36.12 ± 0.5 10-24cm3 (est)