5-(3-nitrophenyl)-1-[2-(1-oxa-4-azoniacyclohex-4-yl)ethyl]-2-oxo-4-(thiophene-2-carbonyl)-5H-pyrrol-3-olate
Molecular Formula:
C
21
H
21
N
3
O
6
S
InChI:
InChI=1/C21H21N3O6S/c25-19(16-5-2-12-31-16)17-18(14-3-1-4-15(13-14)24(28)29)23(21(27)20(17)26)7-6-22-8-10-30-11-9-22/h1-5,12-13,18,26H,6-11H2/f/h26h,22H
InChIKey:
InChIKey=TXUUJIWSPQTMGH-NFWCXGDVCU
SMILES:
C1COCC[NH+]1CCN2C(C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC(=CC=C4)[N+](=O)[O-]
Names:
5-(3-nitrophenyl)-1-[2-(1-oxa-4-azoniacyclohex-4-yl)ethyl]-2-oxo-4-(thiophene-2-carbonyl)-5H-pyrrol-3-olate
Registries:
PubChem CID 4536953
PubChem ID 10215631