IUPAC Name :(2S)-2-[4-(1H-indol-3-yl)butanoylamino]butanedioic acid
InChI :InChI=1/C16H18N2O5/c19-14(18-13(16(22)23)8-15(20)21)7-3-4-10-9-17-12-6-2-1-5-11(10)12/h1-2,5-6,9,13,17H,3-4,7-8H2,(H,18,19)(H,20,21)(H,22,23)/t13-/m0/s1
Std.InChI: InChI=1S/C16H18N2O5/c19-14(18-13(16(22)23)8-15(20)21)7-3-4-10-9-17-12-6-2-1-5-11(10)12/h1-2,5-6,9,13,17H,3-4,7-8H2,(H,18,19)(H,20,21)(H,22,23)/t13-/m0/s1
InChIKey :VZPZSWBXKJFYJG-ZDUSSCGKBH
Std.InChIKey: VZPZSWBXKJFYJG-ZDUSSCGKSA-N
SMILES :C1=CC=C2C(=C1)C(=CN2)CCCC(=O)N[C@@H](CC(=O)O)C(=O)O
Molar Refractivity :81.55 ± 0.5 cm3 (est)
Parachor :630.3 ± 8.0 cm3 (est)
Index of Refraction :1.630 ± 0.05
(est)
Surface Tension :57.4 ± 7.0 dyne/cm (est)
Density :1.39 ± 0.1 g/cm3 (est)
Polarizability :32.33 ± 0.5 10-24cm3 (est)