Summary
Molecular formula: C18H23NO6
SMILES: OCCN1Cc2c(C1=O)cc(c(c2O)CC/C(=C/CC(=O)OC)/C)OInChI: InChI=1S/C18H23NO6/c1-11(4-6-16(22)25-2)3-5-12-15(21)9-13-14(17(12)23)10-19(7-8-20)18(13)24/h4,9,20-21,23H,3,5-8,10H2,1-2H3/b11-4+InChIKey: KGNZYULDBJKXGC-NYYWCZLTSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1NCc2ccccc21
Scaffold Graph/Node level:OC1NCC2CCCCC21
Scaffold Graph level:CC1CCC2CCCCC12
Chemical classification
Kingdom: Organic compounds
Super class: Organoheterocyclic compoundsClass: Isoindoles and derivatives
Sub class: Isoindolines
Synonymous chemical names:erinacerin j
External chemical identifiers:CID_101910496; NPATLAS_NPA019626; CHEMSPIDER_58968872; ZINC_ZINC000299862882
Chemical structure download