IUPAC Name :(7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
InChI :InChI=1/C21H25NO5/c1-22-15-8-6-12-10-18(25-3)20(26-4)21(27-5)19(12)13-7-9-17(24-2)16(23)11-14(13)15/h7,9-11,15,22H,6,8H2,1-5H3/t15-/m0/s1
Std.InChI: InChI=1S/C21H25NO5/c1-22-15-8-6-12-10-18(25-3)20(26-4)21(27-5)19(12)13-7-9-17(24-2)16(23)11-14(13)15/h7,9-11,15,22H,6,8H2,1-5H3/t15-/m0/s1
InChIKey :NNJPGOLRFBJNIW-HNNXBMFYBY
Std.InChIKey: NNJPGOLRFBJNIW-HNNXBMFYSA-N
SMILES :CN[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
MDL: MFCD00075459
Molar Refractivity :101.85 ± 0.4 cm3 (est)
Parachor :802.8 ± 6.0 cm3 (est)
Index of Refraction :1.582 ± 0.03
(est)
Surface Tension :47.9 ± 5.0 dyne/cm (est)
Density :1.21 ± 0.1 g/cm3 (est)
Polarizability :40.37 ± 0.5 10-24cm3 (est)