7-(2,3-dimethylphenyl)-9-(4-nitrophenyl)-5-thia-7-aza-1-azoniabicyclo[4.3.0]non-10-en-9-ol
Molecular Formula:
C
20
H
22
N
3
O
3
S
+
InChI:
InChI=1/C20H22N3O3S/c1-14-5-3-6-18(15(14)2)21-13-20(24,22-11-4-12-27-19(21)22)16-7-9-17(10-8-16)23(25)26/h3,5-10,24H,4,11-13H2,1-2H3/q+1
InChIKey:
InChIKey=GMBGKVSQFDJNGY-UHFFFAOYAT
SMILES:
CC1=C(C(=CC=C1)N2CC([N+]3=C2SCCC3)(C4=CC=C(C=C4)[N+](=O)[O-])O)C
Names:
7-(2,3-dimethylphenyl)-9-(4-nitrophenyl)-5-thia-7-aza-1-azoniabicyclo[4.3.0]non-10-en-9-ol
Registries:
PubChem CID 4462498
PubChem ID 6578999
