3-benzothiazol-2-yl-2-methyl-4-oxo-8-[(1,3,3-trimethyl-6-azoniabicyclo[3.2.1]oct-6-yl)methyl]chromen-7-olate
Molecular Formula:
C
28
H
30
N
2
O
3
S
InChI:
InChI=1/C28H30N2O3S/c1-16-23(26-29-20-7-5-6-8-22(20)34-26)24(32)18-9-10-21(31)19(25(18)33-16)13-30-15-28(4)12-17(30)11-27(2,3)14-28/h5-10,17,31H,11-15H2,1-4H3/f/h31h,30H
InChIKey:
InChIKey=KQYBKHPFDHPYKD-BLBFEPINCT
SMILES:
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)[O-])C[NH+]3CC4(CC3CC(C4)(C)C)C)C5=NC6=CC=CC=C6S5
Names:
3-benzothiazol-2-yl-2-methyl-4-oxo-8-[(1,3,3-trimethyl-6-azoniabicyclo[3.2.1]oct-6-yl)methyl]chromen-7-olate
Registries:
PubChem CID 5244666
PubChem ID 11570838
