(Z)-4-hydroxy-4-oxo-but-2-enoate; 3-methyl-1-[3-(1-oxa-4-azoniacyclohex-4-yl)propyl]-3-phenyl-indol-2-one
Molecular Formula:
C
26
H
30
N
2
O
6
InChI:
InChI=1/C22H26N2O2.C4H4O4/c1-22(18-8-3-2-4-9-18)19-10-5-6-11-20(19)24(21(22)25)13-7-12-23-14-16-26-17-15-23;5-3(6)1-2-4(7)8/h2-6,8-11H,7,12-17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC22H27N2O2.C4H3O4/h23H;5H/q+1;-1
InChIKey:
InChIKey=VNLILKCZPZXNLM-QHYFDHEGDO
SMILES:
CC1(C2=CC=CC=C2N(C1=O)CCC[NH+]3CCOCC3)C4=CC=CC=C4.C(=CC(=O)[O-])C(=O)O
Names:
(Z)-4-hydroxy-4-oxo-but-2-enoate; 3-methyl-1-[3-(1-oxa-4-azoniacyclohex-4-yl)propyl]-3-phenyl-indol-2-one
Registries:
PubChem CID 6434220
PubChem ID 11620908
