but-2-enedioic acid; 5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-diazabicyclo[4.3.0]nona-6,8-diene

Molecular Formula: C21H26N2O6


InChI: InChI=1/C17H22N2O2.C4H4O4/c1-20-16-8-6-13(12-17(16)21-2)5-7-14-15-4-3-10-19(15)11-9-18-14;5-3(6)1-2-4(7)8/h3-4,6,8,10,12,14,18H,5,7,9,11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/f/h;5,7H

InChIKey: InChIKey=XQCSCUQPTGUSNO-VXZWESAODT
SMILES: COC1=C(C=C(C=C1)CCC2C3=CC=CN3CCN2)OC.C(=CC(=O)O)C(=O)O

Names:
    but-2-enedioic acid; 5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-diazabicyclo[4.3.0]nona-6,8-diene

Registries:
    PubChem CID 5717187
    PubChem ID 3291051