[1-[(E)-(4-oxo-3-tert-butyl-1,2,5,7,8-pentazabicyclo[4.3.0]nona-2,6,8-trien-5-yl)iminomethyl]naphthalen-2-yl] 2-methylbenzoate
Molecular Formula:
C
27
H
24
N
6
O
3
InChI:
InChI=1/C27H24N6O3/c1-17-9-5-7-11-19(17)25(35)36-22-14-13-18-10-6-8-12-20(18)21(22)15-29-33-24(34)23(27(2,3)4)31-32-16-28-30-26(32)33/h5-16H,1-4H3/b29-15+
InChIKey:
InChIKey=UJDWRBVYBVOUAP-WKULSOCRBC
SMILES:
CC1=CC=CC=C1C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NN4C(=O)C(=NN5C4=NN=C5)C(C)(C)C
Names:
[1-[(E)-(4-oxo-3-tert-butyl-1,2,5,7,8-pentazabicyclo[4.3.0]nona-2,6,8-trien-5-yl)iminomethyl]naphthalen-2-yl] 2-methylbenzoate
Registries:
PubChem CID 9612650
PubChem ID 11595459