[2-[3-bromo-9-(cyclohexylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 3-nitrobenzoate
Molecular Formula:
C
26
H
23
BrN
4
O
4
InChI:
InChI=1/C26H23BrN4O4/c27-18-13-14-23-29-24(25(30(23)16-18)28-19-8-2-1-3-9-19)21-11-4-5-12-22(21)35-26(32)17-7-6-10-20(15-17)31(33)34/h4-7,10-16,19,28H,1-3,8-9H2
InChIKey:
InChIKey=JWQYFVCIVNNTEL-UHFFFAOYAB
SMILES:
C1CCC(CC1)NC2=C(N=C3N2C=C(C=C3)Br)C4=CC=CC=C4OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]
Names:
[2-[3-bromo-9-(cyclohexylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 3-nitrobenzoate
Registries:
PubChem CID 3545447
PubChem ID 4791115
