3,3-dimethyl-8-(4-oxo-4-thiophen-2-yl-butyl)-1-phenyl-1,8-diaza-3-azoniaspiro[4.5]decan-4-one; (E)-4-hydroxy-4-oxo-but-2-enoate
Molecular Formula:
C27H33N3O6S
InChI: InChI=1/C23H30N3O2S.C4H4O4/c1-26(2)18-25(19-8-4-3-5-9-19)23(22(26)28)12-15-24(16-13-23)14-6-10-20(27)21-11-7-17-29-21;5-3(6)1-2-4(7)8/h3-5,7-9,11,17H,6,10,12-16,18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/q+1;/p-1/b;2-1+/fC23H30N3O2S.C4H3O4/h;5H/qm;-1
InChIKey: InChIKey=AFAYOBGZHBMWCH-VSCLTKREDG
SMILES: C[N+]1(CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=CS3)C4=CC=CC=C4)C.C(=CC(=O)[O-])C(=O)O
Names:
3,3-dimethyl-8-(4-oxo-4-thiophen-2-yl-butyl)-1-phenyl-1,8-diaza-3-azoniaspiro[4.5]decan-4-one; (E)-4-hydroxy-4-oxo-but-2-enoate
Registries:
PubChem CID 5468185
PubChem ID 11690518
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