Cadinine
Molecular Formula:
C
23
H
13
N
3
O
2
InChI:
InChI=1/C23H13N3O2/c27-21-13-7-1-4-10-16(13)24-20(21)19-15-9-3-6-12-18(15)26-22(19)25-17-11-5-2-8-14(17)23(26)28/h1-12,24H/b20-19-
InChIKey:
InChIKey=DXENDDMPDZMHSQ-VXPUYCOJBH
SMILES:
C1=CC=C2C(=C1)C(=O)C(=C3C4=CC=CC=C4N5C3=NC6=CC=CC=C6C5=O)N2
Names:
Cadinine
NSC600586
Registries:
PubChem CID 5320815
PubChem ID 8141800