1-(2-benzoylpyrrol-1-yl)-4-(1-oxa-4-azoniacyclohex-4-yl)butan-2-one; (Z)-4-hydroxy-4-oxo-but-2-enoate
Molecular Formula:
C
23
H
26
N
2
O
7
InChI:
InChI=1/C19H22N2O3.C4H4O4/c22-17(8-10-20-11-13-24-14-12-20)15-21-9-4-7-18(21)19(23)16-5-2-1-3-6-16;5-3(6)1-2-4(7)8/h1-7,9H,8,10-15H2;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC19H23N2O3.C4H3O4/h20H;5H/q+1;-1
InChIKey:
InChIKey=WBZXBKZFRNMGHF-ZZMQHCFSDO
SMILES:
C1COCC[NH+]1CCC(=O)CN2C=CC=C2C(=O)C3=CC=CC=C3.C(=CC(=O)[O-])C(=O)O
Names:
1-(2-benzoylpyrrol-1-yl)-4-(1-oxa-4-azoniacyclohex-4-yl)butan-2-one; (Z)-4-hydroxy-4-oxo-but-2-enoate
Registries:
PubChem CID 6433610
PubChem ID 11620543
