2-[2,5-dimethyl-3-[(E)-2-nitroethenyl]pyrrol-1-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid
Molecular Formula:
C
17
H
18
N
2
O
4
S
InChI:
InChI=1/C17H18N2O4S/c1-10-9-12(7-8-18(22)23)11(2)19(10)16-15(17(20)21)13-5-3-4-6-14(13)24-16/h7-9H,3-6H2,1-2H3,(H,20,21)/b8-7+/f/h20H
InChIKey:
InChIKey=ZIDNLMGLHKDSJN-NRZQMWEXDZ
SMILES:
CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C(=O)O)C)C=C[N+](=O)[O-]
Names:
2-[2,5-dimethyl-3-[(E)-2-nitroethenyl]pyrrol-1-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid
Registries:
PubChem CID 6294556
PubChem ID 11591724