2-(azepan-1-yl)-N-(3-chloro-4-methyl-phenyl)-5-nitro-8-oxa-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraen-4-amine
Molecular Formula:
C
19
H
20
ClN
5
O
3
InChI:
InChI=1/C19H20ClN5O3/c1-12-6-7-13(10-14(12)20)21-15-11-16(24-8-4-2-3-5-9-24)17-18(23-28-22-17)19(15)25(26)27/h6-7,10-11,21H,2-5,8-9H2,1H3
InChIKey:
InChIKey=PEIDBWFHDNNICI-UHFFFAOYAZ
SMILES:
CC1=C(C=C(C=C1)NC2=C(C3=NON=C3C(=C2)N4CCCCCC4)[N+](=O)[O-])Cl
Names:
2-(azepan-1-yl)-N-(3-chloro-4-methyl-phenyl)-5-nitro-8-oxa-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraen-4-amine
Registries:
PubChem CID 3647431
PubChem ID 9826332