Reaction #250496

ord-c4e078ee313b43d48de9772bc6112780

Reaction equation

CC(C)[CH2][Al+][CH2]C(C)C
CC(C)[CH2][Al+][CH2]
Cc1ccccc1
Cc1ccccc1
[Cl-]
[Cl-]
[H-]
[H-]
CC(=O)Oc1c(C(C)(C)C)cc2c(c1C(C)(C)C)CC(C)(CNC(=N)NN)O2
CC(=O)Oc1c(C(C)(C)C)
[NH4+]
[NH4+]
→
CC1(CNC(=N)NN)Cc2c(cc(C(C)(C)C)c(O)c2C(C)(C)C)O1
CC1(CNC(=N)NN)Cc2c(c

Reactants

CC(C)[CH2][Al+][CH2]C(C)C
CC(C)[CH2][Al+][CH2]C(C)C
Cc1ccccc1
Cc1ccccc1
[Cl-]
[Cl-]
[H-]
[H-]
CC(=O)Oc1c(C(C)(C)C)cc2c(c1C(C)(C)C)CC(C)(CNC(=N)NN)O2
CC(=O)Oc1c(C(C)(C)C)cc2c(c1C(C
[NH4+]
[NH4+]

Reagents

None

Source

DOI: 10.1039/C8SC04228DTraining data from https://doi.org/10.1039/C8SC04228D (9/10)