IUPAC Name :(2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]pentanedioic acid
InChI :InChI=1/C15H16N2O5/c18-13(17-12(15(21)22)5-6-14(19)20)7-9-8-16-11-4-2-1-3-10(9)11/h1-4,8,12,16H,5-7H2,(H,17,18)(H,19,20)(H,21,22)/t12-/m0/s1
Std.InChI: InChI=1S/C15H16N2O5/c18-13(17-12(15(21)22)5-6-14(19)20)7-9-8-16-11-4-2-1-3-10(9)11/h1-4,8,12,16H,5-7H2,(H,17,18)(H,19,20)(H,21,22)/t12-/m0/s1
InChIKey :YRKLGWOHYXIKSF-LBPRGKRZBR
Std.InChIKey: YRKLGWOHYXIKSF-LBPRGKRZSA-N
SMILES :C1=CC=C2C(=C1)C(=CN2)CC(=O)N[C@@H](CCC(=O)O)C(=O)O
MDL: MFCD16036311
Molar Refractivity :76.94 ± 0.5 cm3 (est)
Parachor :591.7 ± 8.0 cm3 (est)
Index of Refraction :1.642 ± 0.05
(est)
Surface Tension :59.6 ± 7.0 dyne/cm (est)
Density :1.42 ± 0.1 g/cm3 (est)
Polarizability :30.50 ± 0.5 10-24cm3 (est)