[4-[9-(2,4,4-trimethylpentan-2-ylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 4-methyl-3-nitro-benzoate
Molecular Formula:
C29H32N4O4
InChI: InChI=1/C29H32N4O4/c1-19-10-11-21(17-23(19)33(35)36)27(34)37-22-14-12-20(13-15-22)25-26(31-29(5,6)18-28(2,3)4)32-16-8-7-9-24(32)30-25/h7-17,31H,18H2,1-6H3
InChIKey: InChIKey=PRHHKIRBPFJTMW-UHFFFAOYAX
SMILES: CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=C(N4C=CC=CC4=N3)NC(C)(C)CC(C)(C)C)[N+](=O)[O-]
Names:
[4-[9-(2,4,4-trimethylpentan-2-ylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 4-methyl-3-nitro-benzoate
Registries:
PubChem CID 3553039
PubChem ID 4804493
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